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

Systemtic Name: O2-ethyl O4-propan-2-yl 3-methyl-5-[2-(5-methyl-3-nitro-pyrazol-1-yl)propanoylamino]thiophene-2,4-dicarboxylate Openeye Name: O2-ethyl O4-isopropyl 3-methyl-5-[2-(5-methyl-3-nitro-pyrazol-1-yl)propanoylamino]thiophene-2,4-dicarboxylate CAS Name: 3-methyl-5-[[2-(5-methyl-3-nitro-1-pyrazolyl)-1-oxopropyl]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-[2-(5-methyl-3-nitropyrazol-1-yl)propanoylamino]thiophene-2,4-dicarboxylate Traditional Name: 3-methyl-5-[2-(5-methyl-3-nitro-pyrazol-1-yl)propanoylamino]thiophene-2,4-dicarboxylic acid O2-ethyl ester O4-isopropyl ester Formula: C19H24N4O7S MolecularWeight: 452.48146

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Descriptors Computed from Structure

Canonical SMILES:

CCOC(=O)C1=C(C(=C(S1)NC(=O)C(C)N2C(=CC(=N2)[N+](=O)[O-])C)C(=O)OC(C)C)C

Isomeric SMILES

CCOC(=O)C1=C(C(=C(S1)NC(=O)C(C)N2C(=CC(=N2)[N+](=O)[O-])C)C(=O)OC(C)C)C

InChI

InChI=1S/C19H24N4O7S/c1-7-29-19(26)15-11(5)14(18(25)30-9(2)3)17(31-15)20-16(24)12(6)22-10(4)8-13(21-22)23(27)28/h8-9,12H,7H2,1-6H3,(H,20,24)