methyl N,N'-bis(4-acetamidophenyl)carbamimidothioate

Systemtic Name: methyl N,N'-bis(4-acetamidophenyl)carbamimidothioate Openeye Name: N-[4-[[N-(4-acetamidophenyl)-C-methylsulfanyl-carbonimidoyl]amino]phenyl]acetamide CAS Name: N,N'-bis(4-acetamidophenyl)carbamimidothioic acid methyl ester IUPAC Name: methyl N,N'-bis(4-acetamidophenyl)carbamimidothioate Traditional Name: N-[4-[[N-(4-acetamidophenyl)-C-(methylthio)carbonimidoyl]amino]phenyl]acetamide Formula: C18H20N4O2S MolecularWeight: 356.442

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Descriptors Computed from Structure

Canonical SMILES:

CC(=O)NC1=CC=C(C=C1)NC(=NC2=CC=C(C=C2)NC(=O)C)SC

Isomeric SMILES

CC(=O)NC1=CC=C(C=C1)NC(=NC2=CC=C(C=C2)NC(=O)C)SC

InChI

InChI=1S/C18H20N4O2S/c1-12(23)19-14-4-8-16(9-5-14)21-18(25-3)22-17-10-6-15(7-11-17)20-13(2)24/h4-11H,1-3H3,(H,19,23)(H,20,24)(H,21,22)