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

Systemtic Name: ethyl 4-(4-ethylphenyl)-2-[[(E)-3-(4-hexoxy-3-methoxy-phenyl)prop-2-enoyl]amino]thiophene-3-carboxylate Openeye Name: ethyl 4-(4-ethylphenyl)-2-[[(E)-3-(4-hexoxy-3-methoxy-phenyl)prop-2-enoyl]amino]thiophene-3-carboxylate CAS Name: 4-(4-ethylphenyl)-2-[[(E)-3-(4-hexoxy-3-methoxyphenyl)-1-oxoprop-2-enyl]amino]-3-thiophenecarboxylic acid ethyl ester IUPAC Name: ethyl 4-(4-ethylphenyl)-2-[[(E)-3-(4-hexoxy-3-methoxyphenyl)prop-2-enoyl]amino]thiophene-3-carboxylate Traditional Name: 4-(4-ethylphenyl)-2-[[(E)-3-(4-hexoxy-3-methoxy-phenyl)acryloyl]amino]thiophene-3-carboxylic acid ethyl ester Formula: C31H37NO5S MolecularWeight: 535.69418

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Descriptors Computed from Structure

Canonical SMILES:

CCCCCCOC1=C(C=C(C=C1)C=CC(=O)NC2=C(C(=CS2)C3=CC=C(C=C3)CC)C(=O)OCC)OC

Isomeric SMILES

CCCCCCOC1=C(C=C(C=C1)/C=C/C(=O)NC2=C(C(=CS2)C3=CC=C(C=C3)CC)C(=O)OCC)OC

InChI

InChI=1S/C31H37NO5S/c1-5-8-9-10-19-37-26-17-13-23(20-27(26)35-4)14-18-28(33)32-30-29(31(34)36-7-3)25(21-38-30)24-15-11-22(6-2)12-16-24/h11-18,20-21H,5-10,19H2,1-4H3,(H,32,33)/b18-14+