1-(4-methoxyphenyl)-3-[[N-[(4-methoxyphenyl)carbamothioylamino]-N'-(phenylsulfonyl)carbamimidoyl]amino]thiourea

Systemtic Name: 1-(4-methoxyphenyl)-3-[[N-[(4-methoxyphenyl)carbamothioylamino]-N'-(phenylsulfonyl)carbamimidoyl]amino]thiourea Openeye Name: 1-[[N'-(benzenesulfonyl)-N-[(4-methoxyphenyl)carbamothioylamino]carbamimidoyl]amino]-3-(4-methoxyphenyl)thiourea CAS Name: 1-[[benzenesulfonylimino-[[(4-methoxyanilino)-sulfanylidenemethyl]hydrazo]methyl]amino]-3-(4-methoxyphenyl)thiourea IUPAC Name: 1-[[N'-(benzenesulfonyl)-N-[(4-methoxyphenyl)carbamothioylamino]carbamimidoyl]amino]-3-(4-methoxyphenyl)thiourea Traditional Name: 1-[[N'-besyl-N-[(4-methoxyphenyl)thiocarbamoylamino]amidino]amino]-3-(4-methoxyphenyl)thiourea Formula: C23H25N7O4S3 MolecularWeight: 559.6841

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Descriptors Computed from Structure

Canonical SMILES:

COC1=CC=C(C=C1)NC(=S)NNC(=NS(=O)(=O)C2=CC=CC=C2)NNC(=S)NC3=CC=C(C=C3)OC

Isomeric SMILES

COC1=CC=C(C=C1)NC(=S)NNC(=NS(=O)(=O)C2=CC=CC=C2)NNC(=S)NC3=CC=C(C=C3)OC

InChI

InChI=1S/C23H25N7O4S3/c1-33-18-12-8-16(9-13-18)24-22(35)28-26-21(30-37(31,32)20-6-4-3-5-7-20)27-29-23(36)25-17-10-14-19(34-2)15-11-17/h3-15H,1-2H3,(H2,24,28,35)(H2,25,29,36)(H2,26,27,30)