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

Systemtic Name: methyl 5-aminocarbonyl-4-methyl-2-[3-(5-methyl-4-nitro-pyrazol-1-yl)propanoylamino]thiophene-3-carboxylate Openeye Name: methyl 5-carbamoyl-4-methyl-2-[3-(5-methyl-4-nitro-pyrazol-1-yl)propanoylamino]thiophene-3-carboxylate CAS Name: 5-carbamoyl-4-methyl-2-[[3-(5-methyl-4-nitro-1-pyrazolyl)-1-oxopropyl]amino]-3-thiophenecarboxylic acid methyl ester IUPAC Name: methyl 5-carbamoyl-4-methyl-2-[3-(5-methyl-4-nitropyrazol-1-yl)propanoylamino]thiophene-3-carboxylate Traditional Name: 5-carbamoyl-4-methyl-2-[3-(5-methyl-4-nitro-pyrazol-1-yl)propanoylamino]thiophene-3-carboxylic acid methyl ester Formula: C15H17N5O6S MolecularWeight: 395.39038

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C(SC(=C1C(=O)OC)NC(=O)CCN2C(=C(C=N2)[N+](=O)[O-])C)C(=O)N

Isomeric SMILES

CC1=C(SC(=C1C(=O)OC)NC(=O)CCN2C(=C(C=N2)[N+](=O)[O-])C)C(=O)N

InChI

InChI=1S/C15H17N5O6S/c1-7-11(15(23)26-3)14(27-12(7)13(16)22)18-10(21)4-5-19-8(2)9(6-17-19)20(24)25/h6H,4-5H2,1-3H3,(H2,16,22)(H,18,21)