methyl 5-[[2,6-bis(fluoranyl)phenyl]carbonylamino]-4-cyano-3-methyl-thiophene-2-carboxylate

Systemtic Name: methyl 5-[[2,6-bis(fluoranyl)phenyl]carbonylamino]-4-cyano-3-methyl-thiophene-2-carboxylate Openeye Name: methyl 4-cyano-5-[(2,6-difluorobenzoyl)amino]-3-methyl-thiophene-2-carboxylate CAS Name: 4-cyano-5-[[(2,6-difluorophenyl)-oxomethyl]amino]-3-methyl-2-thiophenecarboxylic acid methyl ester IUPAC Name: methyl 4-cyano-5-[(2,6-difluorobenzoyl)amino]-3-methylthiophene-2-carboxylate Traditional Name: 4-cyano-5-[(2,6-difluorobenzoyl)amino]-3-methyl-thiophene-2-carboxylic acid methyl ester Formula: C15H10F2N2O3S MolecularWeight: 336.313306

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C(SC(=C1C#N)NC(=O)C2=C(C=CC=C2F)F)C(=O)OC

Isomeric SMILES

CC1=C(SC(=C1C#N)NC(=O)C2=C(C=CC=C2F)F)C(=O)OC

InChI

InChI=1S/C15H10F2N2O3S/c1-7-8(6-18)14(23-12(7)15(21)22-2)19-13(20)11-9(16)4-3-5-10(11)17/h3-5H,1-2H3,(H,19,20)