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

Systemtic Name: propyl 5-aminocarbonyl-4-methyl-2-[3-(5-methyl-4-nitro-pyrazol-1-yl)propanoylamino]thiophene-3-carboxylate Openeye Name: propyl 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 propyl ester IUPAC Name: propyl 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 propyl ester Formula: C17H21N5O6S MolecularWeight: 423.44354

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Descriptors Computed from Structure

Canonical SMILES:

CCCOC(=O)C1=C(SC(=C1C)C(=O)N)NC(=O)CCN2C(=C(C=N2)[N+](=O)[O-])C

Isomeric SMILES

CCCOC(=O)C1=C(SC(=C1C)C(=O)N)NC(=O)CCN2C(=C(C=N2)[N+](=O)[O-])C

InChI

InChI=1S/C17H21N5O6S/c1-4-7-28-17(25)13-9(2)14(15(18)24)29-16(13)20-12(23)5-6-21-10(3)11(8-19-21)22(26)27/h8H,4-7H2,1-3H3,(H2,18,24)(H,20,23)