methyl 4-[(E)-2-[5-acetamido-4-(4-methylphenyl)-1,3-thiazol-2-yl]-2-cyano-ethenyl]benzoate

Systemtic Name: methyl 4-[(E)-2-[5-acetamido-4-(4-methylphenyl)-1,3-thiazol-2-yl]-2-cyano-ethenyl]benzoate Openeye Name: methyl 4-[(E)-2-[5-acetamido-4-(p-tolyl)thiazol-2-yl]-2-cyano-vinyl]benzoate CAS Name: 4-[(E)-2-[5-acetamido-4-(4-methylphenyl)-2-thiazolyl]-2-cyanoethenyl]benzoic acid methyl ester IUPAC Name: methyl 4-[(E)-2-[5-acetamido-4-(4-methylphenyl)-1,3-thiazol-2-yl]-2-cyanoethenyl]benzoate Traditional Name: 4-[(E)-2-[5-acetamido-4-(p-tolyl)thiazol-2-yl]-2-cyano-vinyl]benzoic acid methyl ester Formula: C23H19N3O3S MolecularWeight: 417.48026

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC=C(C=C1)C2=C(SC(=N2)C(=CC3=CC=C(C=C3)C(=O)OC)C#N)NC(=O)C

Isomeric SMILES

CC1=CC=C(C=C1)C2=C(SC(=N2)/C(=C/C3=CC=C(C=C3)C(=O)OC)/C#N)NC(=O)C

InChI

InChI=1S/C23H19N3O3S/c1-14-4-8-17(9-5-14)20-22(25-15(2)27)30-21(26-20)19(13-24)12-16-6-10-18(11-7-16)23(28)29-3/h4-12H,1-3H3,(H,25,27)/b19-12+