methyl N-(4-acetamidophenyl)sulfonyl-N'-(phenylmethyl)carbamimidothioate

Systemtic Name: methyl N-(4-acetamidophenyl)sulfonyl-N'-(phenylmethyl)carbamimidothioate Openeye Name: N-[4-[(N-benzyl-C-methylsulfanyl-carbonimidoyl)sulfamoyl]phenyl]acetamide CAS Name: N-(4-acetamidophenyl)sulfonyl-N'-(phenylmethyl)carbamimidothioic acid methyl ester IUPAC Name: methyl N-(4-acetamidophenyl)sulfonyl-N'-benzylcarbamimidothioate Traditional Name: N-[4-[[N-benzyl-C-(methylthio)carbonimidoyl]sulfamoyl]phenyl]acetamide Formula: C17H19N3O3S2 MolecularWeight: 377.48106

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Descriptors Computed from Structure

Canonical SMILES:

CC(=O)NC1=CC=C(C=C1)S(=O)(=O)NC(=NCC2=CC=CC=C2)SC

Isomeric SMILES

CC(=O)NC1=CC=C(C=C1)S(=O)(=O)NC(=NCC2=CC=CC=C2)SC

InChI

InChI=1S/C17H19N3O3S2/c1-13(21)19-15-8-10-16(11-9-15)25(22,23)20-17(24-2)18-12-14-6-4-3-5-7-14/h3-11H,12H2,1-2H3,(H,18,20)(H,19,21)