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

Systemtic Name: methyl 2-[(4-bromanyl-2-ethyl-pyrazol-3-yl)carbonylamino]-5-methyl-thiophene-3-carboxylate Openeye Name: methyl 2-[(4-bromo-2-ethyl-pyrazole-3-carbonyl)amino]-5-methyl-thiophene-3-carboxylate CAS Name: 2-[[(4-bromo-2-ethyl-3-pyrazolyl)-oxomethyl]amino]-5-methyl-3-thiophenecarboxylic acid methyl ester IUPAC Name: methyl 2-[(4-bromo-2-ethylpyrazole-3-carbonyl)amino]-5-methylthiophene-3-carboxylate Traditional Name: 2-[(4-bromo-2-ethyl-pyrazole-3-carbonyl)amino]-5-methyl-thiophene-3-carboxylic acid methyl ester Formula: C13H14BrN3O3S MolecularWeight: 372.23756

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Descriptors Computed from Structure

Canonical SMILES:

CCN1C(=C(C=N1)Br)C(=O)NC2=C(C=C(S2)C)C(=O)OC

Isomeric SMILES

CCN1C(=C(C=N1)Br)C(=O)NC2=C(C=C(S2)C)C(=O)OC

InChI

InChI=1S/C13H14BrN3O3S/c1-4-17-10(9(14)6-15-17)11(18)16-12-8(13(19)20-3)5-7(2)21-12/h5-6H,4H2,1-3H3,(H,16,18)