methyl 5-aminocarbonyl-2-[[1-[bis(fluoranyl)methyl]pyrazol-3-yl]carbonylamino]-4-methyl-thiophene-3-carboxylate

Systemtic Name: methyl 5-aminocarbonyl-2-[[1-[bis(fluoranyl)methyl]pyrazol-3-yl]carbonylamino]-4-methyl-thiophene-3-carboxylate Openeye Name: methyl 5-carbamoyl-2-[[1-(difluoromethyl)pyrazole-3-carbonyl]amino]-4-methyl-thiophene-3-carboxylate CAS Name: 5-carbamoyl-2-[[[1-(difluoromethyl)-3-pyrazolyl]-oxomethyl]amino]-4-methyl-3-thiophenecarboxylic acid methyl ester IUPAC Name: methyl 5-carbamoyl-2-[[1-(difluoromethyl)pyrazole-3-carbonyl]amino]-4-methylthiophene-3-carboxylate Traditional Name: 5-carbamoyl-2-[[1-(difluoromethyl)pyrazole-3-carbonyl]amino]-4-methyl-thiophene-3-carboxylic acid methyl ester Formula: C13H12F2N4O4S MolecularWeight: 358.320586

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C13H12F2N4O4S/c1-5-7(12(22)23-2)11(24-8(5)9(16)20)17-10(21)6-3-4-19(18-6)13(14)15/h3-4,13H,1-2H3,(H2,16,20)(H,17,21)