methyl N-[4-(methylcarbamoyl)phenyl]-N'-(phenylsulfonyl)carbamimidothioate

Systemtic Name: methyl N-[4-(methylcarbamoyl)phenyl]-N'-(phenylsulfonyl)carbamimidothioate Openeye Name: 4-[[(Z)-N-(benzenesulfonyl)-C-methylsulfanyl-carbonimidoyl]amino]-N-methyl-benzamide CAS Name: N'-(benzenesulfonyl)-N-[4-(methylcarbamoyl)phenyl]carbamimidothioic acid methyl ester IUPAC Name: methyl N'-(benzenesulfonyl)-N-[4-(methylcarbamoyl)phenyl]carbamimidothioate Traditional Name: 4-[[(Z)-N-besyl-C-(methylthio)carbonimidoyl]amino]-N-methyl-benzamide Formula: C16H17N3O3S2 MolecularWeight: 363.45448

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Descriptors Computed from Structure

Canonical SMILES:

CNC(=O)C1=CC=C(C=C1)NC(=NS(=O)(=O)C2=CC=CC=C2)SC

Isomeric SMILES

CNC(=O)C1=CC=C(C=C1)N/C(=N/S(=O)(=O)C2=CC=CC=C2)/SC

InChI

InChI=1S/C16H17N3O3S2/c1-17-15(20)12-8-10-13(11-9-12)18-16(23-2)19-24(21,22)14-6-4-3-5-7-14/h3-11H,1-2H3,(H,17,20)(H,18,19)