methyl 5-(4-thiophen-2-ylcarbonylpiperazin-1-yl)-7-(trifluoromethyl)thieno[3,2-b]pyridine-3-carboxylate

Systemtic Name: methyl 5-(4-thiophen-2-ylcarbonylpiperazin-1-yl)-7-(trifluoromethyl)thieno[3,2-b]pyridine-3-carboxylate Openeye Name: methyl 5-[4-(thiophene-2-carbonyl)piperazin-1-yl]-7-(trifluoromethyl)thieno[3,2-b]pyridine-3-carboxylate CAS Name: 5-[4-[oxo(thiophen-2-yl)methyl]-1-piperazinyl]-7-(trifluoromethyl)-3-thieno[3,2-b]pyridinecarboxylic acid methyl ester IUPAC Name: methyl 5-[4-(thiophene-2-carbonyl)piperazin-1-yl]-7-(trifluoromethyl)thieno[3,2-b]pyridine-3-carboxylate Traditional Name: 5-[4-(2-thenoyl)piperazino]-7-(trifluoromethyl)thieno[3,2-b]pyridine-3-carboxylic acid methyl ester Formula: C19H16F3N3O3S2 MolecularWeight: 455.47385

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Descriptors Computed from Structure

Canonical SMILES:

COC(=O)C1=CSC2=C1N=C(C=C2C(F)(F)F)N3CCN(CC3)C(=O)C4=CC=CS4

Isomeric SMILES

COC(=O)C1=CSC2=C1N=C(C=C2C(F)(F)F)N3CCN(CC3)C(=O)C4=CC=CS4

InChI

InChI=1S/C19H16F3N3O3S2/c1-28-18(27)11-10-30-16-12(19(20,21)22)9-14(23-15(11)16)24-4-6-25(7-5-24)17(26)13-3-2-8-29-13/h2-3,8-10H,4-7H2,1H3