N-[2-[(2,6-dimethylphenyl)amino]-2-oxidanylidene-ethyl]-2-methylsulfanyl-3-phenyl-imidazole-4-carboxamide

Systemtic Name: N-[2-[(2,6-dimethylphenyl)amino]-2-oxidanylidene-ethyl]-2-methylsulfanyl-3-phenyl-imidazole-4-carboxamide Openeye Name: N-[2-(2,6-dimethylanilino)-2-oxo-ethyl]-2-methylsulfanyl-3-phenyl-imidazole-4-carboxamide CAS Name: N-[2-(2,6-dimethylanilino)-2-oxoethyl]-2-(methylthio)-3-phenyl-4-imidazolecarboxamide IUPAC Name: N-[2-(2,6-dimethylanilino)-2-oxoethyl]-2-methylsulfanyl-3-phenylimidazole-4-carboxamide Traditional Name: N-[2-(2,6-dimethylanilino)-2-keto-ethyl]-2-(methylthio)-3-phenyl-imidazole-4-carboxamide Formula: C21H22N4O2S MolecularWeight: 394.48998

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

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