O2-ethyl O4-propan-2-yl 3-methyl-5-[(1-methyl-4-nitro-pyrazol-3-yl)carbonylamino]thiophene-2,4-dicarboxylate

Systemtic Name: O2-ethyl O4-propan-2-yl 3-methyl-5-[(1-methyl-4-nitro-pyrazol-3-yl)carbonylamino]thiophene-2,4-dicarboxylate Openeye Name: O2-ethyl O4-isopropyl 3-methyl-5-[(1-methyl-4-nitro-pyrazole-3-carbonyl)amino]thiophene-2,4-dicarboxylate CAS Name: 3-methyl-5-[[(1-methyl-4-nitro-3-pyrazolyl)-oxomethyl]amino]thiophene-2,4-dicarboxylic acid O2-ethyl ester O4-propan-2-yl ester IUPAC Name: 2-O-ethyl 4-O-propan-2-yl 3-methyl-5-[(1-methyl-4-nitropyrazole-3-carbonyl)amino]thiophene-2,4-dicarboxylate Traditional Name: 3-methyl-5-[(1-methyl-4-nitro-pyrazole-3-carbonyl)amino]thiophene-2,4-dicarboxylic acid O2-ethyl ester O4-isopropyl ester Formula: C17H20N4O7S MolecularWeight: 424.4283

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Descriptors Computed from Structure

Canonical SMILES:

CCOC(=O)C1=C(C(=C(S1)NC(=O)C2=NN(C=C2[N+](=O)[O-])C)C(=O)OC(C)C)C

Isomeric SMILES

CCOC(=O)C1=C(C(=C(S1)NC(=O)C2=NN(C=C2[N+](=O)[O-])C)C(=O)OC(C)C)C

InChI

InChI=1S/C17H20N4O7S/c1-6-27-17(24)13-9(4)11(16(23)28-8(2)3)15(29-13)18-14(22)12-10(21(25)26)7-20(5)19-12/h7-8H,6H2,1-5H3,(H,18,22)