N-methyl-N-[2-[(4-methylphenyl)amino]-2-oxidanylidene-ethyl]-2-methylsulfanyl-3-phenyl-imidazole-4-carboxamide

Systemtic Name: N-methyl-N-[2-[(4-methylphenyl)amino]-2-oxidanylidene-ethyl]-2-methylsulfanyl-3-phenyl-imidazole-4-carboxamide Openeye Name: N-methyl-N-[2-(4-methylanilino)-2-oxo-ethyl]-2-methylsulfanyl-3-phenyl-imidazole-4-carboxamide CAS Name: N-methyl-N-[2-(4-methylanilino)-2-oxoethyl]-2-(methylthio)-3-phenyl-4-imidazolecarboxamide IUPAC Name: N-methyl-N-[2-(4-methylanilino)-2-oxoethyl]-2-methylsulfanyl-3-phenylimidazole-4-carboxamide Traditional Name: N-[2-keto-2-(p-toluidino)ethyl]-N-methyl-2-(methylthio)-3-phenyl-imidazole-4-carboxamide Formula: C21H22N4O2S MolecularWeight: 394.48998

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC=C(C=C1)NC(=O)CN(C)C(=O)C2=CN=C(N2C3=CC=CC=C3)SC

Isomeric SMILES

CC1=CC=C(C=C1)NC(=O)CN(C)C(=O)C2=CN=C(N2C3=CC=CC=C3)SC

InChI

InChI=1S/C21H22N4O2S/c1-15-9-11-16(12-10-15)23-19(26)14-24(2)20(27)18-13-22-21(28-3)25(18)17-7-5-4-6-8-17/h4-13H,14H2,1-3H3,(H,23,26)