ethyl 2-[[(E)-3-(4-butoxy-3-methoxy-phenyl)-2-cyano-prop-2-enoyl]amino]-4-(4-methoxyphenyl)thiophene-3-carboxylate

Systemtic Name: ethyl 2-[[(E)-3-(4-butoxy-3-methoxy-phenyl)-2-cyano-prop-2-enoyl]amino]-4-(4-methoxyphenyl)thiophene-3-carboxylate Openeye Name: ethyl 2-[[(E)-3-(4-butoxy-3-methoxy-phenyl)-2-cyano-prop-2-enoyl]amino]-4-(4-methoxyphenyl)thiophene-3-carboxylate CAS Name: 2-[[(E)-3-(4-butoxy-3-methoxyphenyl)-2-cyano-1-oxoprop-2-enyl]amino]-4-(4-methoxyphenyl)-3-thiophenecarboxylic acid ethyl ester IUPAC Name: ethyl 2-[[(E)-3-(4-butoxy-3-methoxyphenyl)-2-cyanoprop-2-enoyl]amino]-4-(4-methoxyphenyl)thiophene-3-carboxylate Traditional Name: 2-[[(E)-3-(4-butoxy-3-methoxy-phenyl)-2-cyano-acryloyl]amino]-4-(4-methoxyphenyl)thiophene-3-carboxylic acid ethyl ester Formula: C29H30N2O6S MolecularWeight: 534.6233

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Descriptors Computed from Structure

Canonical SMILES:

CCCCOC1=C(C=C(C=C1)C=C(C#N)C(=O)NC2=C(C(=CS2)C3=CC=C(C=C3)OC)C(=O)OCC)OC

Isomeric SMILES

CCCCOC1=C(C=C(C=C1)/C=C(\C#N)/C(=O)NC2=C(C(=CS2)C3=CC=C(C=C3)OC)C(=O)OCC)OC

InChI

InChI=1S/C29H30N2O6S/c1-5-7-14-37-24-13-8-19(16-25(24)35-4)15-21(17-30)27(32)31-28-26(29(33)36-6-2)23(18-38-28)20-9-11-22(34-3)12-10-20/h8-13,15-16,18H,5-7,14H2,1-4H3,(H,31,32)/b21-15+