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

Systemtic Name: methyl 5-methyl-2-[(1-methyl-4-nitro-pyrazol-3-yl)carbonylamino]thiophene-3-carboxylate Openeye Name: methyl 5-methyl-2-[(1-methyl-4-nitro-pyrazole-3-carbonyl)amino]thiophene-3-carboxylate CAS Name: 5-methyl-2-[[(1-methyl-4-nitro-3-pyrazolyl)-oxomethyl]amino]-3-thiophenecarboxylic acid methyl ester IUPAC Name: methyl 5-methyl-2-[(1-methyl-4-nitropyrazole-3-carbonyl)amino]thiophene-3-carboxylate Traditional Name: 5-methyl-2-[(1-methyl-4-nitro-pyrazole-3-carbonyl)amino]thiophene-3-carboxylic acid methyl ester Formula: C12H12N4O5S MolecularWeight: 324.31248

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC(=C(S1)NC(=O)C2=NN(C=C2[N+](=O)[O-])C)C(=O)OC

Isomeric SMILES

CC1=CC(=C(S1)NC(=O)C2=NN(C=C2[N+](=O)[O-])C)C(=O)OC

InChI

InChI=1S/C12H12N4O5S/c1-6-4-7(12(18)21-3)11(22-6)13-10(17)9-8(16(19)20)5-15(2)14-9/h4-5H,1-3H3,(H,13,17)