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

Systemtic Name: methyl 5-aminocarbonyl-4-methyl-2-[(1-methyl-4-nitro-pyrazol-3-yl)carbonylamino]thiophene-3-carboxylate Openeye Name: methyl 5-carbamoyl-4-methyl-2-[(1-methyl-4-nitro-pyrazole-3-carbonyl)amino]thiophene-3-carboxylate CAS Name: 5-carbamoyl-4-methyl-2-[[(1-methyl-4-nitro-3-pyrazolyl)-oxomethyl]amino]-3-thiophenecarboxylic acid methyl ester IUPAC Name: methyl 5-carbamoyl-4-methyl-2-[(1-methyl-4-nitropyrazole-3-carbonyl)amino]thiophene-3-carboxylate Traditional Name: 5-carbamoyl-4-methyl-2-[(1-methyl-4-nitro-pyrazole-3-carbonyl)amino]thiophene-3-carboxylic acid methyl ester Formula: C13H13N5O6S MolecularWeight: 367.33722

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C13H13N5O6S/c1-5-7(13(21)24-3)12(25-9(5)10(14)19)15-11(20)8-6(18(22)23)4-17(2)16-8/h4H,1-3H3,(H2,14,19)(H,15,20)