38884 -OEChem-03292404102D 45 45 0 0 0 0 0 0 0999 V2000 3.0000 -2.0000 0.0000 S 0 0 0 0 0 0 0 0 0 0 0 0 3.0000 -1.0000 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 2.0000 -2.0000 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 4.0000 -2.0000 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 5.5981 0.5000 0.0000 N 0 0 0 0 0 0 0 0 0 0 0 0 4.7320 -1.0000 0.0000 N 0 0 0 0 0 0 0 0 0 0 0 0 3.0000 -3.0000 0.0000 N 0 0 0 0 0 0 0 0 0 0 0 0 6.4641 -1.0000 0.0000 N 0 0 0 0 0 0 0 0 0 0 0 0 3.0000 1.0000 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 3.0000 2.0000 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 3.8660 0.5000 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 2.1340 2.5000 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 4.7320 1.0000 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 3.8660 -0.5000 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 2.1340 3.5000 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 5.5981 -0.5000 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 4.7320 2.0000 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 7.3301 -0.5000 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 2.1340 -3.5000 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 3.8660 -3.5000 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 8.1962 -1.0000 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 2.3894 1.1077 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 2.7880 0.4174 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 3.6106 1.8923 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 3.2120 2.5826 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 1.5234 2.6077 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 1.9219 1.9174 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 2.7540 3.5000 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 2.1340 4.1200 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 1.5140 3.5000 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 5.3520 2.0000 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 4.7320 2.6200 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 4.1120 2.0000 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 6.4641 -1.6200 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 7.7287 -0.0251 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 6.9316 -0.0251 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 1.8240 -2.9631 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 1.5970 -3.8100 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 2.4440 -4.0369 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 3.5560 -4.0369 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 4.4030 -3.8100 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 4.1760 -2.9631 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 7.8862 -1.5369 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 8.7331 -1.3100 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 8.5062 -0.4631 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 1 2 1 0 0 0 0 1 3 2 0 0 0 0 1 4 2 0 0 0 0 1 7 1 0 0 0 0 2 14 1 0 0 0 0 5 13 1 0 0 0 0 5 16 2 0 0 0 0 6 14 2 0 0 0 0 6 16 1 0 0 0 0 7 19 1 0 0 0 0 7 20 1 0 0 0 0 8 16 1 0 0 0 0 8 18 1 0 0 0 0 8 34 1 0 0 0 0 9 10 1 0 0 0 0 9 11 1 0 0 0 0 9 22 1 0 0 0 0 9 23 1 0 0 0 0 10 12 1 0 0 0 0 10 24 1 0 0 0 0 10 25 1 0 0 0 0 11 13 2 0 0 0 0 11 14 1 0 0 0 0 12 15 1 0 0 0 0 12 26 1 0 0 0 0 12 27 1 0 0 0 0 13 17 1 0 0 0 0 15 28 1 0 0 0 0 15 29 1 0 0 0 0 15 30 1 0 0 0 0 17 31 1 0 0 0 0 17 32 1 0 0 0 0 17 33 1 0 0 0 0 18 21 1 0 0 0 0 18 35 1 0 0 0 0 18 36 1 0 0 0 0 19 37 1 0 0 0 0 19 38 1 0 0 0 0 19 39 1 0 0 0 0 20 40 1 0 0 0 0 20 41 1 0 0 0 0 20 42 1 0 0 0 0 21 43 1 0 0 0 0 21 44 1 0 0 0 0 21 45 1 0 0 0 0 M END > 38884 > 1 > 397 > 7 > 1 > 8 > AAADceBzsABAAAAAAAAAAAAAAAAAAAAAAAAsAAAAAAAAAAABgAAAHgAQQAAADAjBngQDlJbIEACgAwRgZDCAgCkhIKABGKA8TBiALgJA2MKEFAhukBpISCOQwAAOAAAAAAAAAAAAAAAAAAAAAAAAAAAAAA== > [5-butyl-2-(ethylamino)-6-methyl-pyrimidin-4-yl] N,N-dimethylsulfamate > N,N-dimethylsulfamic acid [5-butyl-2-(ethylamino)-6-methyl-4-pyrimidinyl] ester > [5-butyl-2-(ethylamino)-6-methylpyrimidin-4-yl] N,N-dimethylsulfamate > [5-butyl-2-(ethylamino)-6-methylpyrimidin-4-yl] N,N-dimethylsulfamate > [5-butyl-2-(ethylamino)-6-methyl-pyrimidin-4-yl] N,N-dimethylsulfamate > N,N-dimethylsulfamic acid [5-butyl-2-(ethylamino)-6-methyl-pyrimidin-4-yl] ester > InChI=1S/C13H24N4O3S/c1-6-8-9-11-10(3)15-13(14-7-2)16-12(11)20-21(18,19)17(4)5/h6-9H2,1-5H3,(H,14,15,16) > DSKJPMWIHSOYEA-UHFFFAOYSA-N > 2.7 > 316.15691181 > C13H24N4O3S > 316.42 > CCCCC1=C(N=C(N=C1OS(=O)(=O)N(C)C)NCC)C > CCCCC1=C(N=C(N=C1OS(=O)(=O)N(C)C)NCC)C > 92.8 > 316.15691181 > 0 > 21 > 0 > 0 > 0 > 0 > 0 > 1 > -1 > 1 5 255 > 11 13 8 11 14 8 5 13 8 5 16 8 6 14 8 6 16 8 $$$$