ethyl 2-[[2-cyano-3-(4-ethoxyphenyl)prop-2-enoyl]amino]-4-(4-ethylphenyl)thiophene-3-carboxylate

Systemtic Name: ethyl 2-[[2-cyano-3-(4-ethoxyphenyl)prop-2-enoyl]amino]-4-(4-ethylphenyl)thiophene-3-carboxylate Openeye Name: ethyl 2-[[2-cyano-3-(4-ethoxyphenyl)prop-2-enoyl]amino]-4-(4-ethylphenyl)thiophene-3-carboxylate CAS Name: 2-[[2-cyano-3-(4-ethoxyphenyl)-1-oxoprop-2-enyl]amino]-4-(4-ethylphenyl)-3-thiophenecarboxylic acid ethyl ester IUPAC Name: ethyl 2-[[2-cyano-3-(4-ethoxyphenyl)prop-2-enoyl]amino]-4-(4-ethylphenyl)thiophene-3-carboxylate Traditional Name: 2-[(2-cyano-3-p-phenetyl-acryloyl)amino]-4-(4-ethylphenyl)thiophene-3-carboxylic acid ethyl ester Formula: C27H26N2O4S MolecularWeight: 474.57134

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Descriptors Computed from Structure

Canonical SMILES:

CCC1=CC=C(C=C1)C2=CSC(=C2C(=O)OCC)NC(=O)C(=CC3=CC=C(C=C3)OCC)C#N

Isomeric SMILES

CCC1=CC=C(C=C1)C2=CSC(=C2C(=O)OCC)NC(=O)C(=CC3=CC=C(C=C3)OCC)C#N

InChI

InChI=1S/C27H26N2O4S/c1-4-18-7-11-20(12-8-18)23-17-34-26(24(23)27(31)33-6-3)29-25(30)21(16-28)15-19-9-13-22(14-10-19)32-5-2/h7-15,17H,4-6H2,1-3H3,(H,29,30)