4096 1 2 3 4 5 6 7 8 9 10 11 12 13 14 15 16 15 8 8 7 6 6 1 1 1 1 1 1 1 1 1 1 2 2 2 3 5 5 6 6 6 7 7 7 2 6 3 4 5 7 8 9 10 11 12 13 14 15 1 1 1 2 1 1 1 1 1 1 1 1 1 1 2 1 3 4 5 3 1 1 5 255 1 2 3 4 5 6 7 8 9 10 11 12 13 14 15 4.269 3.403 2.903 3.903 2.5369 5.135 3.403 2 2.5369 4.825 5.672 5.445 3.9399 3.713 2.866 0.194 -0.306 0.56 -1.172 -0.806 -0.306 1.426 -0.496 -1.426 -0.843 -0.616 0.2309 1.116 1.963 1.736 3 2 5 0 Compound Canonicalized 5 2021.10.14 1 Compound Complexity 7 E_COMPLEXITY 3.4.8.18 Cactvs Xemistry GmbH 2021.10.14 95.7 Count Hydrogen Bond Acceptor 5 E_NHACCEPTORS 3.4.8.18 Cactvs Xemistry GmbH 2021.10.14 4 Count Hydrogen Bond Donor 5 E_NHDONORS 3.4.8.18 Cactvs Xemistry GmbH 2021.10.14 1 Count Rotatable Bond 5 E_NROTBONDS 3.4.8.18 Cactvs Xemistry GmbH 2021.10.14 2 Fingerprint SubStructure Keys 16 extended 2 E_SCREEN 3.4.8.18 Cactvs Xemistry GmbH 2021.10.14 00000371C04230024000000000000000000000000000000000000000000000000000000000000012041080200000000000028200000001100040000000800000000000000000000000000000000000000000000000000000000000000000000000000000000000000000000000000000000000 IUPAC Name Allowed 1 2.7.0 Lexichem TK OpenEye Scientific Software 2021.10.14 [amino(methylsulfanyl)phosphoryl]oxymethane IUPAC Name CAS-like Style 1 2.7.0 Lexichem TK OpenEye Scientific Software 2021.10.14 [amino-(methylthio)phosphoryl]oxymethane IUPAC Name Markup 1 2.7.0 Lexichem TK OpenEye Scientific Software 2021.10.14 [amino(methylsulfanyl)phosphoryl]oxymethane IUPAC Name Preferred 1 2.7.0 Lexichem TK OpenEye Scientific Software 2021.10.14 [amino(methylsulfanyl)phosphoryl]oxymethane IUPAC Name Systematic 1 2.7.0 Lexichem TK OpenEye Scientific Software 2021.10.14 [azanyl(methylsulfanyl)phosphoryl]oxymethane IUPAC Name Traditional 1 2.7.0 Lexichem TK OpenEye Scientific Software 2021.10.14 [methoxy-(methylthio)phosphoryl]amine InChI Standard 1 1.0.6 InChI iupac.org 2021.10.14 InChI=1S/C2H8NO2PS/c1-5-6(3,4)7-2/h1-2H3,(H2,3,4) InChIKey Standard 1 1.0.6 InChI iupac.org 2021.10.14 NNKVPIKMPCQWCG-UHFFFAOYSA-N Log P XLogP3-AA 7 3.0 sioc-ccbg.ac.cn 2021.10.14 -0.9 Mass Exact 1 2.2 PubChem ncbi.nlm.nih.gov 2021.10.14 141.00133667 Molecular Formula 1 2.2 PubChem ncbi.nlm.nih.gov 2021.10.14 C2H8NO2PS Molecular Weight 1 2.2 PubChem ncbi.nlm.nih.gov 2021.10.14 141.13 SMILES Canonical 1 2.3.0 OEChem OpenEye Scientific Software 2021.10.14 COP(=O)(N)SC SMILES Isomeric 1 2.3.0 OEChem OpenEye Scientific Software 2021.10.14 COP(=O)(N)SC Topological Polar Surface Area 7 E_TPSA 3.4.8.18 Cactvs Xemistry GmbH 2021.10.14 77.6 Weight MonoIsotopic 1 2.2 PubChem ncbi.nlm.nih.gov 2021.10.14 141.00133667 7 1 0 1 0 0 0 0 1 -1