2-(pyridin-4-ylmethylsulfanyl)-N-[3-(trifluoromethyl)thiophen-2-yl]pyridine-3-carboxamide

Systemtic Name: 2-(pyridin-4-ylmethylsulfanyl)-N-[3-(trifluoromethyl)thiophen-2-yl]pyridine-3-carboxamide Openeye Name: 2-(4-pyridylmethylsulfanyl)-N-[3-(trifluoromethyl)-2-thienyl]pyridine-3-carboxamide CAS Name: 2-(pyridin-4-ylmethylthio)-N-[3-(trifluoromethyl)-2-thiophenyl]-3-pyridinecarboxamide IUPAC Name: 2-(pyridin-4-ylmethylsulfanyl)-N-[3-(trifluoromethyl)thiophen-2-yl]pyridine-3-carboxamide Traditional Name: 2-(4-pyridylmethylthio)-N-[3-(trifluoromethyl)-2-thienyl]nicotinamide Formula: C17H12F3N3OS2 MolecularWeight: 395.42189

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

C1=CC(=C(N=C1)SCC2=CC=NC=C2)C(=O)NC3=C(C=CS3)C(F)(F)F

Isomeric SMILES

C1=CC(=C(N=C1)SCC2=CC=NC=C2)C(=O)NC3=C(C=CS3)C(F)(F)F

InChI

InChI=1S/C17H12F3N3OS2/c18-17(19,20)13-5-9-25-16(13)23-14(24)12-2-1-6-22-15(12)26-10-11-3-7-21-8-4-11/h1-9H,10H2,(H,23,24)