ethyl 4-(4-chlorophenyl)-2-[[2-cyano-3-(2-propan-2-yloxyphenyl)prop-2-enoyl]amino]thiophene-3-carboxylate

Systemtic Name: ethyl 4-(4-chlorophenyl)-2-[[2-cyano-3-(2-propan-2-yloxyphenyl)prop-2-enoyl]amino]thiophene-3-carboxylate Openeye Name: ethyl 4-(4-chlorophenyl)-2-[[2-cyano-3-(2-isopropoxyphenyl)prop-2-enoyl]amino]thiophene-3-carboxylate CAS Name: 4-(4-chlorophenyl)-2-[[2-cyano-1-oxo-3-(2-propan-2-yloxyphenyl)prop-2-enyl]amino]-3-thiophenecarboxylic acid ethyl ester IUPAC Name: ethyl 4-(4-chlorophenyl)-2-[[2-cyano-3-(2-propan-2-yloxyphenyl)prop-2-enoyl]amino]thiophene-3-carboxylate Traditional Name: 4-(4-chlorophenyl)-2-[[2-cyano-3-(2-isopropoxyphenyl)acryloyl]amino]thiophene-3-carboxylic acid ethyl ester Formula: C26H23ClN2O4S MolecularWeight: 494.98982

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Descriptors Computed from Structure

Canonical SMILES:

CCOC(=O)C1=C(SC=C1C2=CC=C(C=C2)Cl)NC(=O)C(=CC3=CC=CC=C3OC(C)C)C#N

Isomeric SMILES

CCOC(=O)C1=C(SC=C1C2=CC=C(C=C2)Cl)NC(=O)C(=CC3=CC=CC=C3OC(C)C)C#N

InChI

InChI=1S/C26H23ClN2O4S/c1-4-32-26(31)23-21(17-9-11-20(27)12-10-17)15-34-25(23)29-24(30)19(14-28)13-18-7-5-6-8-22(18)33-16(2)3/h5-13,15-16H,4H2,1-3H3,(H,29,30)