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

Systemtic Name: 3-(4-fluorophenyl)-N-methyl-N-[2-[(4-methylphenyl)amino]-2-oxidanylidene-ethyl]-2-methylsulfanyl-imidazole-4-carboxamide Openeye Name: 3-(4-fluorophenyl)-N-methyl-N-[2-(4-methylanilino)-2-oxo-ethyl]-2-methylsulfanyl-imidazole-4-carboxamide CAS Name: 3-(4-fluorophenyl)-N-methyl-N-[2-(4-methylanilino)-2-oxoethyl]-2-(methylthio)-4-imidazolecarboxamide IUPAC Name: 3-(4-fluorophenyl)-N-methyl-N-[2-(4-methylanilino)-2-oxoethyl]-2-methylsulfanylimidazole-4-carboxamide Traditional Name: 3-(4-fluorophenyl)-N-[2-keto-2-(p-toluidino)ethyl]-N-methyl-2-(methylthio)imidazole-4-carboxamide Formula: C21H21FN4O2S MolecularWeight: 412.480443

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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=C(C=C3)F)SC

Isomeric SMILES

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

InChI

InChI=1S/C21H21FN4O2S/c1-14-4-8-16(9-5-14)24-19(27)13-25(2)20(28)18-12-23-21(29-3)26(18)17-10-6-15(22)7-11-17/h4-12H,13H2,1-3H3,(H,24,27)