ethyl 2-[3-(4-fluorophenyl)prop-2-enoylamino]-4-(4-methoxyphenyl)thiophene-3-carboxylate

Systemtic Name: ethyl 2-[3-(4-fluorophenyl)prop-2-enoylamino]-4-(4-methoxyphenyl)thiophene-3-carboxylate Openeye Name: ethyl 2-[3-(4-fluorophenyl)prop-2-enoylamino]-4-(4-methoxyphenyl)thiophene-3-carboxylate CAS Name: 2-[[3-(4-fluorophenyl)-1-oxoprop-2-enyl]amino]-4-(4-methoxyphenyl)-3-thiophenecarboxylic acid ethyl ester IUPAC Name: ethyl 2-[3-(4-fluorophenyl)prop-2-enoylamino]-4-(4-methoxyphenyl)thiophene-3-carboxylate Traditional Name: 2-[[3-(4-fluorophenyl)acryloyl]amino]-4-(4-methoxyphenyl)thiophene-3-carboxylic acid ethyl ester Formula: C23H20FNO4S MolecularWeight: 425.472603

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Descriptors Computed from Structure

Canonical SMILES:

CCOC(=O)C1=C(SC=C1C2=CC=C(C=C2)OC)NC(=O)C=CC3=CC=C(C=C3)F

Isomeric SMILES

CCOC(=O)C1=C(SC=C1C2=CC=C(C=C2)OC)NC(=O)C=CC3=CC=C(C=C3)F

InChI

InChI=1S/C23H20FNO4S/c1-3-29-23(27)21-19(16-7-11-18(28-2)12-8-16)14-30-22(21)25-20(26)13-6-15-4-9-17(24)10-5-15/h4-14H,3H2,1-2H3,(H,25,26)