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

Systemtic Name: propyl 5-(dimethylcarbamoyl)-4-methyl-2-[2-(3-methyl-4-nitro-pyrazol-1-yl)ethanoylamino]thiophene-3-carboxylate Openeye Name: propyl 5-(dimethylcarbamoyl)-4-methyl-2-[[2-(3-methyl-4-nitro-pyrazol-1-yl)acetyl]amino]thiophene-3-carboxylate CAS Name: 5-[dimethylamino(oxo)methyl]-4-methyl-2-[[2-(3-methyl-4-nitro-1-pyrazolyl)-1-oxoethyl]amino]-3-thiophenecarboxylic acid propyl ester IUPAC Name: propyl 5-(dimethylcarbamoyl)-4-methyl-2-[[2-(3-methyl-4-nitropyrazol-1-yl)acetyl]amino]thiophene-3-carboxylate Traditional Name: 5-(dimethylcarbamoyl)-4-methyl-2-[[2-(3-methyl-4-nitro-pyrazol-1-yl)acetyl]amino]thiophene-3-carboxylic acid propyl ester Formula: C18H23N5O6S MolecularWeight: 437.47012

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Descriptors Computed from Structure

Canonical SMILES:

CCCOC(=O)C1=C(SC(=C1C)C(=O)N(C)C)NC(=O)CN2C=C(C(=N2)C)[N+](=O)[O-]

Isomeric SMILES

CCCOC(=O)C1=C(SC(=C1C)C(=O)N(C)C)NC(=O)CN2C=C(C(=N2)C)[N+](=O)[O-]

InChI

InChI=1S/C18H23N5O6S/c1-6-7-29-18(26)14-10(2)15(17(25)21(4)5)30-16(14)19-13(24)9-22-8-12(23(27)28)11(3)20-22/h8H,6-7,9H2,1-5H3,(H,19,24)