methyl (NZ)-N-[[(2-acetamido-4-phenylsulfanyl-phenyl)-(2-phenylethanoyl)amino]-azanyl-methylidene]carbamate

Systemtic Name: methyl (NZ)-N-[[(2-acetamido-4-phenylsulfanyl-phenyl)-(2-phenylethanoyl)amino]-azanyl-methylidene]carbamate Openeye Name: methyl (NZ)-N-[(2-acetamido-N-(2-phenylacetyl)-4-phenylsulfanyl-anilino)-amino-methylene]carbamate CAS Name: (NZ)-N-[[2-acetamido-N-(1-oxo-2-phenylethyl)-4-(phenylthio)anilino]-aminomethylidene]carbamic acid methyl ester IUPAC Name: methyl (NZ)-N-[(2-acetamido-N-(2-phenylacetyl)-4-phenylsulfanylanilino)-aminomethylidene]carbamate Traditional Name: (NZ)-N-[[2-acetamido-N-(2-phenylacetyl)-4-(phenylthio)anilino]-amino-methylene]carbamic acid methyl ester Formula: C25H24N4O4S MolecularWeight: 476.54746

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Descriptors Computed from Structure

Canonical SMILES:

CC(=O)NC1=C(C=CC(=C1)SC2=CC=CC=C2)N(C(=O)CC3=CC=CC=C3)C(=NC(=O)OC)N

Isomeric SMILES

CC(=O)NC1=C(C=CC(=C1)SC2=CC=CC=C2)N(C(=O)CC3=CC=CC=C3)/C(=N\C(=O)OC)/N

InChI

InChI=1S/C25H24N4O4S/c1-17(30)27-21-16-20(34-19-11-7-4-8-12-19)13-14-22(21)29(24(26)28-25(32)33-2)23(31)15-18-9-5-3-6-10-18/h3-14,16H,15H2,1-2H3,(H,27,30)(H2,26,28,32)