ethyl 5-methyl-4-phenyl-2-[3-(4-propan-2-ylphenyl)prop-2-enoylamino]thiophene-3-carboxylate

Systemtic Name: ethyl 5-methyl-4-phenyl-2-[3-(4-propan-2-ylphenyl)prop-2-enoylamino]thiophene-3-carboxylate Openeye Name: ethyl 2-[3-(4-isopropylphenyl)prop-2-enoylamino]-5-methyl-4-phenyl-thiophene-3-carboxylate CAS Name: 5-methyl-2-[[1-oxo-3-(4-propan-2-ylphenyl)prop-2-enyl]amino]-4-phenyl-3-thiophenecarboxylic acid ethyl ester IUPAC Name: ethyl 5-methyl-4-phenyl-2-[3-(4-propan-2-ylphenyl)prop-2-enoylamino]thiophene-3-carboxylate Traditional Name: 5-methyl-2-[(3-p-cumenylacryloyl)amino]-4-phenyl-thiophene-3-carboxylic acid ethyl ester Formula: C26H27NO3S MolecularWeight: 433.56248

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Descriptors Computed from Structure

Canonical SMILES:

CCOC(=O)C1=C(SC(=C1C2=CC=CC=C2)C)NC(=O)C=CC3=CC=C(C=C3)C(C)C

Isomeric SMILES

CCOC(=O)C1=C(SC(=C1C2=CC=CC=C2)C)NC(=O)C=CC3=CC=C(C=C3)C(C)C

InChI

InChI=1S/C26H27NO3S/c1-5-30-26(29)24-23(21-9-7-6-8-10-21)18(4)31-25(24)27-22(28)16-13-19-11-14-20(15-12-19)17(2)3/h6-17H,5H2,1-4H3,(H,27,28)