methyl 4-aminocarbonyl-5-[[(E)-3-(4-fluorophenyl)prop-2-enoyl]amino]-3-methyl-thiophene-2-carboxylate

Systemtic Name: methyl 4-aminocarbonyl-5-[[(E)-3-(4-fluorophenyl)prop-2-enoyl]amino]-3-methyl-thiophene-2-carboxylate Openeye Name: methyl 4-carbamoyl-5-[[(E)-3-(4-fluorophenyl)prop-2-enoyl]amino]-3-methyl-thiophene-2-carboxylate CAS Name: 4-carbamoyl-5-[[(E)-3-(4-fluorophenyl)-1-oxoprop-2-enyl]amino]-3-methyl-2-thiophenecarboxylic acid methyl ester IUPAC Name: methyl 4-carbamoyl-5-[[(E)-3-(4-fluorophenyl)prop-2-enoyl]amino]-3-methylthiophene-2-carboxylate Traditional Name: 4-carbamoyl-5-[[(E)-3-(4-fluorophenyl)acryloyl]amino]-3-methyl-thiophene-2-carboxylic acid methyl ester Formula: C17H15FN2O4S MolecularWeight: 362.375403

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C(SC(=C1C(=O)N)NC(=O)C=CC2=CC=C(C=C2)F)C(=O)OC

Isomeric SMILES

CC1=C(SC(=C1C(=O)N)NC(=O)/C=C/C2=CC=C(C=C2)F)C(=O)OC

InChI

InChI=1S/C17H15FN2O4S/c1-9-13(15(19)22)16(25-14(9)17(23)24-2)20-12(21)8-5-10-3-6-11(18)7-4-10/h3-8H,1-2H3,(H2,19,22)(H,20,21)/b8-5+