69450334
  -OEChem-04262419532D

 32 34  0     0  0  0  0  0  0999 V2000
    4.6783   -1.4832    0.0000 S   0  0  0  0  0  0  0  0  0  0  0  0
    2.0000   -1.1784    0.0000 O   0  0  0  0  0  0  0  0  0  0  0  0
    5.9674    1.2831    0.0000 O   0  0  0  0  0  0  0  0  0  0  0  0
    8.3497   -2.3535    0.0000 O   0  0  0  0  0  0  0  0  0  0  0  0
    6.2619   -2.4105    0.0000 O   0  0  0  0  0  0  0  0  0  0  0  0
    6.2619   -0.6784    0.0000 N   0  0  0  0  0  0  0  0  0  0  0  0
    4.3211    1.8211    0.0000 N   0  0  0  0  0  0  0  0  0  0  0  0
    3.7320   -0.1784    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    2.8660    0.3216    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    3.7320   -1.1784    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    4.6783    0.1263    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    2.0000   -0.1784    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    2.8660   -1.6784    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    5.2619   -0.6784    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    4.9889    1.0768    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    6.7619   -1.5444    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    7.7619   -1.5444    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    8.3497   -0.7354    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    9.3007   -1.0444    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    9.3007   -2.0444    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    3.2646    0.7965    0.0000 H   0  0  0  0  0  0  0  0  0  0  0  0
    2.4675    0.7965    0.0000 H   0  0  0  0  0  0  0  0  0  0  0  0
    1.7880    0.4042    0.0000 H   0  0  0  0  0  0  0  0  0  0  0  0
    1.3894   -0.2861    0.0000 H   0  0  0  0  0  0  0  0  0  0  0  0
    2.4675   -2.1534    0.0000 H   0  0  0  0  0  0  0  0  0  0  0  0
    3.2646   -2.1534    0.0000 H   0  0  0  0  0  0  0  0  0  0  0  0
    6.5719   -0.1415    0.0000 H   0  0  0  0  0  0  0  0  0  0  0  0
    4.5137    2.4105    0.0000 H   0  0  0  0  0  0  0  0  0  0  0  0
    3.7144    1.6933    0.0000 H   0  0  0  0  0  0  0  0  0  0  0  0
    8.1581   -0.1458    0.0000 H   0  0  0  0  0  0  0  0  0  0  0  0
    9.8023   -0.6800    0.0000 H   0  0  0  0  0  0  0  0  0  0  0  0
    9.8023   -2.4089    0.0000 H   0  0  0  0  0  0  0  0  0  0  0  0
  1 10  1  0  0  0  0
  1 14  1  0  0  0  0
  2 12  1  0  0  0  0
  2 13  1  0  0  0  0
  3 15  2  0  0  0  0
  4 17  1  0  0  0  0
  4 20  1  0  0  0  0
  5 16  2  0  0  0  0
  6 14  1  0  0  0  0
  6 16  1  0  0  0  0
  6 27  1  0  0  0  0
  7 15  1  0  0  0  0
  7 28  1  0  0  0  0
  7 29  1  0  0  0  0
  8  9  1  0  0  0  0
  8 10  2  0  0  0  0
  8 11  1  0  0  0  0
  9 12  1  0  0  0  0
  9 21  1  0  0  0  0
  9 22  1  0  0  0  0
 10 13  1  0  0  0  0
 11 14  2  0  0  0  0
 11 15  1  0  0  0  0
 12 23  1  0  0  0  0
 12 24  1  0  0  0  0
 13 25  1  0  0  0  0
 13 26  1  0  0  0  0
 16 17  1  0  0  0  0
 17 18  2  0  0  0  0
 18 19  1  0  0  0  0
 18 30  1  0  0  0  0
 19 20  2  0  0  0  0
 19 31  1  0  0  0  0
 20 32  1  0  0  0  0
M  END
> <PUBCHEM_COMPOUND_CID>
69450334

> <PUBCHEM_COMPOUND_CANONICALIZED>
1

> <PUBCHEM_CACTVS_COMPLEXITY>
406

> <PUBCHEM_CACTVS_HBOND_ACCEPTOR>
5

> <PUBCHEM_CACTVS_HBOND_DONOR>
2

> <PUBCHEM_CACTVS_ROTATABLE_BOND>
3

> <PUBCHEM_CACTVS_SUBSKEYS>
AAADccBzOABAAAAAAAAAAAAAAAAAASJAAAAkAAAAAAAAAEgB4AAAHgQQAAAADASh2AIwhYLABEiMAqlS0AKDCIBlKBkIiBHGTMgOJjrk9b+HGajkxBH46caYFwIOgAAAAAAAAAAAAAAAAAAAAAAAAAAAAA==

> <PUBCHEM_IUPAC_OPENEYE_NAME>
2-(furan-2-carbonylamino)-5,7-dihydro-4H-thieno[2,3-c]pyran-3-carboxamide

> <PUBCHEM_IUPAC_CAS_NAME>
2-[[2-furanyl(oxo)methyl]amino]-5,7-dihydro-4H-thieno[2,3-c]pyran-3-carboxamide

> <PUBCHEM_IUPAC_NAME_MARKUP>
2-(furan-2-carbonylamino)-5,7-dihydro-4<I>H</I>-thieno[2,3-c]pyran-3-carboxamide

> <PUBCHEM_IUPAC_NAME>
2-(furan-2-carbonylamino)-5,7-dihydro-4H-thieno[2,3-c]pyran-3-carboxamide

> <PUBCHEM_IUPAC_SYSTEMATIC_NAME>
2-(furan-2-ylcarbonylamino)-5,7-dihydro-4H-thieno[2,3-c]pyran-3-carboxamide

> <PUBCHEM_IUPAC_TRADITIONAL_NAME>
2-(2-furoylamino)-5,7-dihydro-4H-thieno[2,3-c]pyran-3-carboxamide

> <PUBCHEM_IUPAC_INCHI>
InChI=1S/C13H12N2O4S/c14-11(16)10-7-3-5-18-6-9(7)20-13(10)15-12(17)8-2-1-4-19-8/h1-2,4H,3,5-6H2,(H2,14,16)(H,15,17)

> <PUBCHEM_IUPAC_INCHIKEY>
QDRQMYSSFVYCKW-UHFFFAOYSA-N

> <PUBCHEM_XLOGP3_AA>
1.3

> <PUBCHEM_EXACT_MASS>
292.05177804

> <PUBCHEM_MOLECULAR_FORMULA>
C13H12N2O4S

> <PUBCHEM_MOLECULAR_WEIGHT>
292.31

> <PUBCHEM_OPENEYE_CAN_SMILES>
C1COCC2=C1C(=C(S2)NC(=O)C3=CC=CO3)C(=O)N

> <PUBCHEM_OPENEYE_ISO_SMILES>
C1COCC2=C1C(=C(S2)NC(=O)C3=CC=CO3)C(=O)N

> <PUBCHEM_CACTVS_TPSA>
123

> <PUBCHEM_MONOISOTOPIC_WEIGHT>
292.05177804

> <PUBCHEM_TOTAL_CHARGE>
0

> <PUBCHEM_HEAVY_ATOM_COUNT>
20

> <PUBCHEM_ATOM_DEF_STEREO_COUNT>
0

> <PUBCHEM_ATOM_UDEF_STEREO_COUNT>
0

> <PUBCHEM_BOND_DEF_STEREO_COUNT>
0

> <PUBCHEM_BOND_UDEF_STEREO_COUNT>
0

> <PUBCHEM_ISOTOPIC_ATOM_COUNT>
0

> <PUBCHEM_COMPONENT_COUNT>
1

> <PUBCHEM_CACTVS_TAUTO_COUNT>
-1

> <PUBCHEM_COORDINATE_TYPE>
1
5
255

> <PUBCHEM_BONDANNOTATIONS>
1  10  8
1  14  8
11  14  8
17  18  8
18  19  8
19  20  8
4  17  8
4  20  8
8  10  8
8  11  8

$$$$