ethyl 2-[[(E)-3-(4-butoxyphenyl)prop-2-enoyl]amino]-4-(4-ethoxyphenyl)thiophene-3-carboxylate

Systemtic Name: ethyl 2-[[(E)-3-(4-butoxyphenyl)prop-2-enoyl]amino]-4-(4-ethoxyphenyl)thiophene-3-carboxylate Openeye Name: ethyl 2-[[(E)-3-(4-butoxyphenyl)prop-2-enoyl]amino]-4-(4-ethoxyphenyl)thiophene-3-carboxylate CAS Name: 2-[[(E)-3-(4-butoxyphenyl)-1-oxoprop-2-enyl]amino]-4-(4-ethoxyphenyl)-3-thiophenecarboxylic acid ethyl ester IUPAC Name: ethyl 2-[[(E)-3-(4-butoxyphenyl)prop-2-enoyl]amino]-4-(4-ethoxyphenyl)thiophene-3-carboxylate Traditional Name: 2-[[(E)-3-(4-butoxyphenyl)acryloyl]amino]-4-p-phenetyl-thiophene-3-carboxylic acid ethyl ester Formula: C28H31NO5S MolecularWeight: 493.61444

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

CCCCOC1=CC=C(C=C1)/C=C/C(=O)NC2=C(C(=CS2)C3=CC=C(C=C3)OCC)C(=O)OCC

InChI

InChI=1S/C28H31NO5S/c1-4-7-18-34-23-13-8-20(9-14-23)10-17-25(30)29-27-26(28(31)33-6-3)24(19-35-27)21-11-15-22(16-12-21)32-5-2/h8-17,19H,4-7,18H2,1-3H3,(H,29,30)/b17-10+