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

Systemtic Name: ethyl 4-(4-chlorophenyl)-5-methyl-2-[3-(4-propan-2-ylphenyl)prop-2-enoylamino]thiophene-3-carboxylate Openeye Name: ethyl 4-(4-chlorophenyl)-2-[3-(4-isopropylphenyl)prop-2-enoylamino]-5-methyl-thiophene-3-carboxylate CAS Name: 4-(4-chlorophenyl)-5-methyl-2-[[1-oxo-3-(4-propan-2-ylphenyl)prop-2-enyl]amino]-3-thiophenecarboxylic acid ethyl ester IUPAC Name: ethyl 4-(4-chlorophenyl)-5-methyl-2-[3-(4-propan-2-ylphenyl)prop-2-enoylamino]thiophene-3-carboxylate Traditional Name: 4-(4-chlorophenyl)-5-methyl-2-[(3-p-cumenylacryloyl)amino]thiophene-3-carboxylic acid ethyl ester Formula: C26H26ClNO3S MolecularWeight: 468.00754

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C26H26ClNO3S/c1-5-31-26(30)24-23(20-11-13-21(27)14-12-20)17(4)32-25(24)28-22(29)15-8-18-6-9-19(10-7-18)16(2)3/h6-16H,5H2,1-4H3,(H,28,29)