N3-[1-[4-(5-methoxypyrimidin-4-yl)piperazin-1-yl]-2-propyl-indol-5-yl]-1-oxidanylidene-1,2,5-thiadiazole-3,4-diamine

Systemtic Name: N3-[1-[4-(5-methoxypyrimidin-4-yl)piperazin-1-yl]-2-propyl-indol-5-yl]-1-oxidanylidene-1,2,5-thiadiazole-3,4-diamine Openeye Name: N3-[1-[4-(5-methoxypyrimidin-4-yl)piperazin-1-yl]-2-propyl-indol-5-yl]-1-oxo-1,2,5-thiadiazole-3,4-diamine CAS Name: N3-[1-[4-(5-methoxy-4-pyrimidinyl)-1-piperazinyl]-2-propyl-5-indolyl]-1-oxo-1,2,5-thiadiazole-3,4-diamine IUPAC Name: 3-N-[1-[4-(5-methoxypyrimidin-4-yl)piperazin-1-yl]-2-propylindol-5-yl]-1-oxo-1,2,5-thiadiazole-3,4-diamine Traditional Name: (4-amino-1-keto-1,2,5-thiadiazol-3-yl)-[1-[4-(5-methoxypyrimidin-4-yl)piperazino]-2-propyl-indol-5-yl]amine Formula: C22H27N9O2S MolecularWeight: 481.57388

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Descriptors Computed from Structure

Canonical SMILES:

CCCC1=CC2=C(N1N3CCN(CC3)C4=NC=NC=C4OC)C=CC(=C2)NC5=NS(=O)N=C5N

Isomeric SMILES

CCCC1=CC2=C(N1N3CCN(CC3)C4=NC=NC=C4OC)C=CC(=C2)NC5=NS(=O)N=C5N

InChI

InChI=1S/C22H27N9O2S/c1-3-4-17-12-15-11-16(26-21-20(23)27-34(32)28-21)5-6-18(15)31(17)30-9-7-29(8-10-30)22-19(33-2)13-24-14-25-22/h5-6,11-14H,3-4,7-10H2,1-2H3,(H2,23,27)(H,26,28)