dimethyl 5-azanyl-3-[[3-chloranyl-2-oxidanylidene-5-(trifluoromethyl)pyridin-1-yl]methyl]thiophene-2,4-dicarboxylate

Systemtic Name: dimethyl 5-azanyl-3-[[3-chloranyl-2-oxidanylidene-5-(trifluoromethyl)pyridin-1-yl]methyl]thiophene-2,4-dicarboxylate Openeye Name: dimethyl 5-amino-3-[[3-chloro-2-oxo-5-(trifluoromethyl)-1-pyridyl]methyl]thiophene-2,4-dicarboxylate CAS Name: 5-amino-3-[[3-chloro-2-oxo-5-(trifluoromethyl)-1-pyridinyl]methyl]thiophene-2,4-dicarboxylic acid dimethyl ester IUPAC Name: dimethyl 5-amino-3-[[3-chloro-2-oxo-5-(trifluoromethyl)pyridin-1-yl]methyl]thiophene-2,4-dicarboxylate Traditional Name: 5-amino-3-[[3-chloro-2-keto-5-(trifluoromethyl)-1-pyridyl]methyl]thiophene-2,4-dicarboxylic acid dimethyl ester Formula: C15H12ClF3N2O5S MolecularWeight: 424.77939

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Descriptors Computed from Structure

Canonical SMILES:

COC(=O)C1=C(SC(=C1CN2C=C(C=C(C2=O)Cl)C(F)(F)F)C(=O)OC)N

Isomeric SMILES

COC(=O)C1=C(SC(=C1CN2C=C(C=C(C2=O)Cl)C(F)(F)F)C(=O)OC)N

InChI

InChI=1S/C15H12ClF3N2O5S/c1-25-13(23)9-7(10(14(24)26-2)27-11(9)20)5-21-4-6(15(17,18)19)3-8(16)12(21)22/h3-4H,5,20H2,1-2H3