ethyl 5-[(4-bromanylthiophen-2-yl)carbonylamino]-1-methyl-pyrazole-4-carboxylate

Systemtic Name: ethyl 5-[(4-bromanylthiophen-2-yl)carbonylamino]-1-methyl-pyrazole-4-carboxylate Openeye Name: ethyl 5-[(4-bromothiophene-2-carbonyl)amino]-1-methyl-pyrazole-4-carboxylate CAS Name: 5-[[(4-bromo-2-thiophenyl)-oxomethyl]amino]-1-methyl-4-pyrazolecarboxylic acid ethyl ester IUPAC Name: ethyl 5-[(4-bromothiophene-2-carbonyl)amino]-1-methylpyrazole-4-carboxylate Traditional Name: 5-[(4-bromothiophene-2-carbonyl)amino]-1-methyl-pyrazole-4-carboxylic acid ethyl ester Formula: C12H12BrN3O3S MolecularWeight: 358.21098

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Descriptors Computed from Structure

Canonical SMILES:

CCOC(=O)C1=C(N(N=C1)C)NC(=O)C2=CC(=CS2)Br

Isomeric SMILES

CCOC(=O)C1=C(N(N=C1)C)NC(=O)C2=CC(=CS2)Br

InChI

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