methyl 3-[(4-bromanyl-2-ethyl-pyrazol-3-yl)carbonylamino]thiophene-2-carboxylate

Systemtic Name: methyl 3-[(4-bromanyl-2-ethyl-pyrazol-3-yl)carbonylamino]thiophene-2-carboxylate Openeye Name: methyl 3-[(4-bromo-2-ethyl-pyrazole-3-carbonyl)amino]thiophene-2-carboxylate CAS Name: 3-[[(4-bromo-2-ethyl-3-pyrazolyl)-oxomethyl]amino]-2-thiophenecarboxylic acid methyl ester IUPAC Name: methyl 3-[(4-bromo-2-ethylpyrazole-3-carbonyl)amino]thiophene-2-carboxylate Traditional Name: 3-[(4-bromo-2-ethyl-pyrazole-3-carbonyl)amino]thiophene-2-carboxylic acid methyl ester Formula: C12H12BrN3O3S MolecularWeight: 358.21098

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Descriptors Computed from Structure

Canonical SMILES:

CCN1C(=C(C=N1)Br)C(=O)NC2=C(SC=C2)C(=O)OC

Isomeric SMILES

CCN1C(=C(C=N1)Br)C(=O)NC2=C(SC=C2)C(=O)OC

InChI

InChI=1S/C12H12BrN3O3S/c1-3-16-9(7(13)6-14-16)11(17)15-8-4-5-20-10(8)12(18)19-2/h4-6H,3H2,1-2H3,(H,15,17)