methyl (E)-4-[4-(4-chlorophenyl)-1-(4-methylphenyl)imidazol-2-yl]sulfanylbut-2-enoate

Systemtic Name: methyl (E)-4-[4-(4-chlorophenyl)-1-(4-methylphenyl)imidazol-2-yl]sulfanylbut-2-enoate Openeye Name: methyl (E)-4-[4-(4-chlorophenyl)-1-(p-tolyl)imidazol-2-yl]sulfanylbut-2-enoate CAS Name: (E)-4-[[4-(4-chlorophenyl)-1-(4-methylphenyl)-2-imidazolyl]thio]-2-butenoic acid methyl ester IUPAC Name: methyl (E)-4-[4-(4-chlorophenyl)-1-(4-methylphenyl)imidazol-2-yl]sulfanylbut-2-enoate Traditional Name: (E)-4-[[4-(4-chlorophenyl)-1-(p-tolyl)imidazol-2-yl]thio]but-2-enoic acid methyl ester Formula: C21H19ClN2O2S MolecularWeight: 398.90576

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC=C(C=C1)N2C=C(N=C2SCC=CC(=O)OC)C3=CC=C(C=C3)Cl

Isomeric SMILES

CC1=CC=C(C=C1)N2C=C(N=C2SC/C=C/C(=O)OC)C3=CC=C(C=C3)Cl

InChI

InChI=1S/C21H19ClN2O2S/c1-15-5-11-18(12-6-15)24-14-19(16-7-9-17(22)10-8-16)23-21(24)27-13-3-4-20(25)26-2/h3-12,14H,13H2,1-2H3/b4-3+