methyl 2-[[2-cyano-3-(4-propan-2-ylphenyl)prop-2-enoyl]amino]-5-methyl-4-phenyl-thiophene-3-carboxylate

Systemtic Name: methyl 2-[[2-cyano-3-(4-propan-2-ylphenyl)prop-2-enoyl]amino]-5-methyl-4-phenyl-thiophene-3-carboxylate Openeye Name: methyl 2-[[2-cyano-3-(4-isopropylphenyl)prop-2-enoyl]amino]-5-methyl-4-phenyl-thiophene-3-carboxylate CAS Name: 2-[[2-cyano-1-oxo-3-(4-propan-2-ylphenyl)prop-2-enyl]amino]-5-methyl-4-phenyl-3-thiophenecarboxylic acid methyl ester IUPAC Name: methyl 2-[[2-cyano-3-(4-propan-2-ylphenyl)prop-2-enoyl]amino]-5-methyl-4-phenylthiophene-3-carboxylate Traditional Name: 2-[(2-cyano-3-p-cumenyl-acryloyl)amino]-5-methyl-4-phenyl-thiophene-3-carboxylic acid methyl ester Formula: C26H24N2O3S MolecularWeight: 444.54536

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C(C(=C(S1)NC(=O)C(=CC2=CC=C(C=C2)C(C)C)C#N)C(=O)OC)C3=CC=CC=C3

Isomeric SMILES

CC1=C(C(=C(S1)NC(=O)C(=CC2=CC=C(C=C2)C(C)C)C#N)C(=O)OC)C3=CC=CC=C3

InChI

InChI=1S/C26H24N2O3S/c1-16(2)19-12-10-18(11-13-19)14-21(15-27)24(29)28-25-23(26(30)31-4)22(17(3)32-25)20-8-6-5-7-9-20/h5-14,16H,1-4H3,(H,28,29)