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

Systemtic Name: methyl 5-aminocarbonyl-4-methyl-2-[(4-nitro-1H-pyrazol-5-yl)carbonylamino]thiophene-3-carboxylate Openeye Name: methyl 5-carbamoyl-4-methyl-2-[(4-nitro-1H-pyrazole-5-carbonyl)amino]thiophene-3-carboxylate CAS Name: 5-carbamoyl-4-methyl-2-[[(4-nitro-1H-pyrazol-5-yl)-oxomethyl]amino]-3-thiophenecarboxylic acid methyl ester IUPAC Name: methyl 5-carbamoyl-4-methyl-2-[(4-nitro-1H-pyrazole-5-carbonyl)amino]thiophene-3-carboxylate Traditional Name: 5-carbamoyl-4-methyl-2-[(4-nitro-1H-pyrazole-5-carbonyl)amino]thiophene-3-carboxylic acid methyl ester Formula: C12H11N5O6S MolecularWeight: 353.31064

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C(SC(=C1C(=O)OC)NC(=O)C2=C(C=NN2)[N+](=O)[O-])C(=O)N

Isomeric SMILES

CC1=C(SC(=C1C(=O)OC)NC(=O)C2=C(C=NN2)[N+](=O)[O-])C(=O)N

InChI

InChI=1S/C12H11N5O6S/c1-4-6(12(20)23-2)11(24-8(4)9(13)18)15-10(19)7-5(17(21)22)3-14-16-7/h3H,1-2H3,(H2,13,18)(H,14,16)(H,15,19)