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

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

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CCOC(=O)C1=C(SC(=C1C)C(=O)N)NC(=O)C(C)N2C=C(C=N2)[N+](=O)[O-]

Isomeric SMILES

CCOC(=O)C1=C(SC(=C1C)C(=O)N)NC(=O)C(C)N2C=C(C=N2)[N+](=O)[O-]

InChI

InChI=1S/C15H17N5O6S/c1-4-26-15(23)10-7(2)11(12(16)21)27-14(10)18-13(22)8(3)19-6-9(5-17-19)20(24)25/h5-6,8H,4H2,1-3H3,(H2,16,21)(H,18,22)