ethyl 2-[3-(4-butoxyphenyl)prop-2-enoylamino]-5-ethyl-thiophene-3-carboxylate

Systemtic Name: ethyl 2-[3-(4-butoxyphenyl)prop-2-enoylamino]-5-ethyl-thiophene-3-carboxylate Openeye Name: ethyl 2-[3-(4-butoxyphenyl)prop-2-enoylamino]-5-ethyl-thiophene-3-carboxylate CAS Name: 2-[[3-(4-butoxyphenyl)-1-oxoprop-2-enyl]amino]-5-ethyl-3-thiophenecarboxylic acid ethyl ester IUPAC Name: ethyl 2-[3-(4-butoxyphenyl)prop-2-enoylamino]-5-ethylthiophene-3-carboxylate Traditional Name: 2-[[3-(4-butoxyphenyl)acryloyl]amino]-5-ethyl-thiophene-3-carboxylic acid ethyl ester Formula: C22H27NO4S MolecularWeight: 401.51908

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Descriptors Computed from Structure

Canonical SMILES:

CCCCOC1=CC=C(C=C1)C=CC(=O)NC2=C(C=C(S2)CC)C(=O)OCC

Isomeric SMILES

CCCCOC1=CC=C(C=C1)C=CC(=O)NC2=C(C=C(S2)CC)C(=O)OCC

InChI

InChI=1S/C22H27NO4S/c1-4-7-14-27-17-11-8-16(9-12-17)10-13-20(24)23-21-19(22(25)26-6-3)15-18(5-2)28-21/h8-13,15H,4-7,14H2,1-3H3,(H,23,24)