methyl 2-[[4-bromanyl-1-methyl-5-(trifluoromethyl)pyrazol-3-yl]carbonylamino]-5-methyl-thiophene-3-carboxylate

Systemtic Name: methyl 2-[[4-bromanyl-1-methyl-5-(trifluoromethyl)pyrazol-3-yl]carbonylamino]-5-methyl-thiophene-3-carboxylate Openeye Name: methyl 2-[[4-bromo-1-methyl-5-(trifluoromethyl)pyrazole-3-carbonyl]amino]-5-methyl-thiophene-3-carboxylate CAS Name: 2-[[[4-bromo-1-methyl-5-(trifluoromethyl)-3-pyrazolyl]-oxomethyl]amino]-5-methyl-3-thiophenecarboxylic acid methyl ester IUPAC Name: methyl 2-[[4-bromo-1-methyl-5-(trifluoromethyl)pyrazole-3-carbonyl]amino]-5-methylthiophene-3-carboxylate Traditional Name: 2-[[4-bromo-1-methyl-5-(trifluoromethyl)pyrazole-3-carbonyl]amino]-5-methyl-thiophene-3-carboxylic acid methyl ester Formula: C13H11BrF3N3O3S MolecularWeight: 426.20895

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC(=C(S1)NC(=O)C2=NN(C(=C2Br)C(F)(F)F)C)C(=O)OC

Isomeric SMILES

CC1=CC(=C(S1)NC(=O)C2=NN(C(=C2Br)C(F)(F)F)C)C(=O)OC

InChI

InChI=1S/C13H11BrF3N3O3S/c1-5-4-6(12(22)23-3)11(24-5)18-10(21)8-7(14)9(13(15,16)17)20(2)19-8/h4H,1-3H3,(H,18,21)