ethyl 4-cyclopropyl-2-[2-(3,5-dimethyl-4-nitro-pyrazol-1-yl)ethanoylamino]thiophene-3-carboxylate

Systemtic Name: ethyl 4-cyclopropyl-2-[2-(3,5-dimethyl-4-nitro-pyrazol-1-yl)ethanoylamino]thiophene-3-carboxylate Openeye Name: ethyl 4-cyclopropyl-2-[[2-(3,5-dimethyl-4-nitro-pyrazol-1-yl)acetyl]amino]thiophene-3-carboxylate CAS Name: 4-cyclopropyl-2-[[2-(3,5-dimethyl-4-nitro-1-pyrazolyl)-1-oxoethyl]amino]-3-thiophenecarboxylic acid ethyl ester IUPAC Name: ethyl 4-cyclopropyl-2-[[2-(3,5-dimethyl-4-nitropyrazol-1-yl)acetyl]amino]thiophene-3-carboxylate Traditional Name: 4-cyclopropyl-2-[[2-(3,5-dimethyl-4-nitro-pyrazol-1-yl)acetyl]amino]thiophene-3-carboxylic acid ethyl ester Formula: C17H20N4O5S MolecularWeight: 392.4295

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Descriptors Computed from Structure

Canonical SMILES:

CCOC(=O)C1=C(SC=C1C2CC2)NC(=O)CN3C(=C(C(=N3)C)[N+](=O)[O-])C

Isomeric SMILES

CCOC(=O)C1=C(SC=C1C2CC2)NC(=O)CN3C(=C(C(=N3)C)[N+](=O)[O-])C

InChI

InChI=1S/C17H20N4O5S/c1-4-26-17(23)14-12(11-5-6-11)8-27-16(14)18-13(22)7-20-10(3)15(21(24)25)9(2)19-20/h8,11H,4-7H2,1-3H3,(H,18,22)