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

Systemtic Name: methyl 2-[(3-methoxy-4-nitro-1H-pyrazol-5-yl)carbonylamino]-5-methyl-thiophene-3-carboxylate Openeye Name: methyl 2-[(3-methoxy-4-nitro-1H-pyrazole-5-carbonyl)amino]-5-methyl-thiophene-3-carboxylate CAS Name: 2-[[(3-methoxy-4-nitro-1H-pyrazol-5-yl)-oxomethyl]amino]-5-methyl-3-thiophenecarboxylic acid methyl ester IUPAC Name: methyl 2-[(3-methoxy-4-nitro-1H-pyrazole-5-carbonyl)amino]-5-methylthiophene-3-carboxylate Traditional Name: 2-[(3-methoxy-4-nitro-1H-pyrazole-5-carbonyl)amino]-5-methyl-thiophene-3-carboxylic acid methyl ester Formula: C12H12N4O6S MolecularWeight: 340.31188

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC(=C(S1)NC(=O)C2=C(C(=NN2)OC)[N+](=O)[O-])C(=O)OC

Isomeric SMILES

CC1=CC(=C(S1)NC(=O)C2=C(C(=NN2)OC)[N+](=O)[O-])C(=O)OC

InChI

InChI=1S/C12H12N4O6S/c1-5-4-6(12(18)22-3)11(23-5)13-9(17)7-8(16(19)20)10(21-2)15-14-7/h4H,1-3H3,(H,13,17)(H,14,15)