O2-ethyl O4-methyl 3-methyl-5-[[2-methyl-3-(4-nitropyrazol-1-yl)propanoyl]amino]thiophene-2,4-dicarboxylate

Systemtic Name: O2-ethyl O4-methyl 3-methyl-5-[[2-methyl-3-(4-nitropyrazol-1-yl)propanoyl]amino]thiophene-2,4-dicarboxylate Openeye Name: O2-ethyl O4-methyl 3-methyl-5-[[2-methyl-3-(4-nitropyrazol-1-yl)propanoyl]amino]thiophene-2,4-dicarboxylate CAS Name: 3-methyl-5-[[2-methyl-3-(4-nitro-1-pyrazolyl)-1-oxopropyl]amino]thiophene-2,4-dicarboxylic acid O2-ethyl ester O4-methyl ester IUPAC Name: 2-O-ethyl 4-O-methyl 3-methyl-5-[[2-methyl-3-(4-nitropyrazol-1-yl)propanoyl]amino]thiophene-2,4-dicarboxylate Traditional Name: 3-methyl-5-[[2-methyl-3-(4-nitropyrazol-1-yl)propanoyl]amino]thiophene-2,4-dicarboxylic acid O2-ethyl ester O4-methyl 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)C(C)CN2C=C(C=N2)[N+](=O)[O-])C(=O)OC)C

Isomeric SMILES

CCOC(=O)C1=C(C(=C(S1)NC(=O)C(C)CN2C=C(C=N2)[N+](=O)[O-])C(=O)OC)C

InChI

InChI=1S/C17H20N4O7S/c1-5-28-17(24)13-10(3)12(16(23)27-4)15(29-13)19-14(22)9(2)7-20-8-11(6-18-20)21(25)26/h6,8-9H,5,7H2,1-4H3,(H,19,22)