propan-2-yl 5-[[(E)-3-(2-chloranyl-6-fluoranyl-phenyl)prop-2-enoyl]amino]-4-cyano-3-methyl-thiophene-2-carboxylate

Systemtic Name: propan-2-yl 5-[[(E)-3-(2-chloranyl-6-fluoranyl-phenyl)prop-2-enoyl]amino]-4-cyano-3-methyl-thiophene-2-carboxylate Openeye Name: isopropyl 5-[[(E)-3-(2-chloro-6-fluoro-phenyl)prop-2-enoyl]amino]-4-cyano-3-methyl-thiophene-2-carboxylate CAS Name: 5-[[(E)-3-(2-chloro-6-fluorophenyl)-1-oxoprop-2-enyl]amino]-4-cyano-3-methyl-2-thiophenecarboxylic acid propan-2-yl ester IUPAC Name: propan-2-yl 5-[[(E)-3-(2-chloro-6-fluorophenyl)prop-2-enoyl]amino]-4-cyano-3-methylthiophene-2-carboxylate Traditional Name: 5-[[(E)-3-(2-chloro-6-fluoro-phenyl)acryloyl]amino]-4-cyano-3-methyl-thiophene-2-carboxylic acid isopropyl ester Formula: C19H16ClFN2O3S MolecularWeight: 406.858343

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C(SC(=C1C#N)NC(=O)C=CC2=C(C=CC=C2Cl)F)C(=O)OC(C)C

Isomeric SMILES

CC1=C(SC(=C1C#N)NC(=O)/C=C/C2=C(C=CC=C2Cl)F)C(=O)OC(C)C

InChI

InChI=1S/C19H16ClFN2O3S/c1-10(2)26-19(25)17-11(3)13(9-22)18(27-17)23-16(24)8-7-12-14(20)5-4-6-15(12)21/h4-8,10H,1-3H3,(H,23,24)/b8-7+