[2-(4-propan-2-ylphenyl)-1,3-thiazol-4-yl]methyl (E)-2-cyano-3-(4-methoxyphenyl)prop-2-enoate

Systemtic Name: [2-(4-propan-2-ylphenyl)-1,3-thiazol-4-yl]methyl (E)-2-cyano-3-(4-methoxyphenyl)prop-2-enoate Openeye Name: [2-(4-isopropylphenyl)thiazol-4-yl]methyl (E)-2-cyano-3-(4-methoxyphenyl)prop-2-enoate CAS Name: (E)-2-cyano-3-(4-methoxyphenyl)-2-propenoic acid [2-(4-propan-2-ylphenyl)-4-thiazolyl]methyl ester IUPAC Name: [2-(4-propan-2-ylphenyl)-1,3-thiazol-4-yl]methyl (E)-2-cyano-3-(4-methoxyphenyl)prop-2-enoate Traditional Name: (E)-2-cyano-3-(4-methoxyphenyl)acrylic acid (2-p-cumenylthiazol-4-yl)methyl ester Formula: C24H22N2O3S MolecularWeight: 418.50808

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)C1=CC=C(C=C1)C2=NC(=CS2)COC(=O)C(=CC3=CC=C(C=C3)OC)C#N

Isomeric SMILES

CC(C)C1=CC=C(C=C1)C2=NC(=CS2)COC(=O)/C(=C/C3=CC=C(C=C3)OC)/C#N

InChI

InChI=1S/C24H22N2O3S/c1-16(2)18-6-8-19(9-7-18)23-26-21(15-30-23)14-29-24(27)20(13-25)12-17-4-10-22(28-3)11-5-17/h4-12,15-16H,14H2,1-3H3/b20-12+