methyl 2-[3-(4-chlorophenyl)prop-2-enoylamino]-4-(4-fluorophenyl)-5-methyl-thiophene-3-carboxylate

Systemtic Name: methyl 2-[3-(4-chlorophenyl)prop-2-enoylamino]-4-(4-fluorophenyl)-5-methyl-thiophene-3-carboxylate Openeye Name: methyl 2-[3-(4-chlorophenyl)prop-2-enoylamino]-4-(4-fluorophenyl)-5-methyl-thiophene-3-carboxylate CAS Name: 2-[[3-(4-chlorophenyl)-1-oxoprop-2-enyl]amino]-4-(4-fluorophenyl)-5-methyl-3-thiophenecarboxylic acid methyl ester IUPAC Name: methyl 2-[3-(4-chlorophenyl)prop-2-enoylamino]-4-(4-fluorophenyl)-5-methylthiophene-3-carboxylate Traditional Name: 2-[[3-(4-chlorophenyl)acryloyl]amino]-4-(4-fluorophenyl)-5-methyl-thiophene-3-carboxylic acid methyl ester Formula: C22H17ClFNO3S MolecularWeight: 429.891683

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C(C(=C(S1)NC(=O)C=CC2=CC=C(C=C2)Cl)C(=O)OC)C3=CC=C(C=C3)F

Isomeric SMILES

CC1=C(C(=C(S1)NC(=O)C=CC2=CC=C(C=C2)Cl)C(=O)OC)C3=CC=C(C=C3)F

InChI

InChI=1S/C22H17ClFNO3S/c1-13-19(15-6-10-17(24)11-7-15)20(22(27)28-2)21(29-13)25-18(26)12-5-14-3-8-16(23)9-4-14/h3-12H,1-2H3,(H,25,26)