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

Systemtic Name: ethyl 2-[[(E)-3-(2-butoxyphenyl)prop-2-enoyl]amino]-4-(4-ethylphenyl)thiophene-3-carboxylate Openeye Name: ethyl 2-[[(E)-3-(2-butoxyphenyl)prop-2-enoyl]amino]-4-(4-ethylphenyl)thiophene-3-carboxylate CAS Name: 2-[[(E)-3-(2-butoxyphenyl)-1-oxoprop-2-enyl]amino]-4-(4-ethylphenyl)-3-thiophenecarboxylic acid ethyl ester IUPAC Name: ethyl 2-[[(E)-3-(2-butoxyphenyl)prop-2-enoyl]amino]-4-(4-ethylphenyl)thiophene-3-carboxylate Traditional Name: 2-[[(E)-3-(2-butoxyphenyl)acryloyl]amino]-4-(4-ethylphenyl)thiophene-3-carboxylic acid ethyl ester Formula: C28H31NO4S MolecularWeight: 477.61504

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Descriptors Computed from Structure

Canonical SMILES:

CCCCOC1=CC=CC=C1C=CC(=O)NC2=C(C(=CS2)C3=CC=C(C=C3)CC)C(=O)OCC

Isomeric SMILES

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

InChI

InChI=1S/C28H31NO4S/c1-4-7-18-33-24-11-9-8-10-22(24)16-17-25(30)29-27-26(28(31)32-6-3)23(19-34-27)21-14-12-20(5-2)13-15-21/h8-17,19H,4-7,18H2,1-3H3,(H,29,30)/b17-16+