3-(pyridin-4-ylmethylsulfanyl)-N-[3-(trifluoromethyloxy)phenyl]thiophene-2-carboxamide

Systemtic Name: 3-(pyridin-4-ylmethylsulfanyl)-N-[3-(trifluoromethyloxy)phenyl]thiophene-2-carboxamide Openeye Name: 3-(4-pyridylmethylsulfanyl)-N-[3-(trifluoromethoxy)phenyl]thiophene-2-carboxamide CAS Name: 3-(pyridin-4-ylmethylthio)-N-[3-(trifluoromethoxy)phenyl]-2-thiophenecarboxamide IUPAC Name: 3-(pyridin-4-ylmethylsulfanyl)-N-[3-(trifluoromethoxy)phenyl]thiophene-2-carboxamide Traditional Name: 3-(4-pyridylmethylthio)-N-[3-(trifluoromethoxy)phenyl]thiophene-2-carboxamide Formula: C18H13F3N2O2S2 MolecularWeight: 410.43323

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC(=CC(=C1)OC(F)(F)F)NC(=O)C2=C(C=CS2)SCC3=CC=NC=C3

Isomeric SMILES

C1=CC(=CC(=C1)OC(F)(F)F)NC(=O)C2=C(C=CS2)SCC3=CC=NC=C3

InChI

InChI=1S/C18H13F3N2O2S2/c19-18(20,21)25-14-3-1-2-13(10-14)23-17(24)16-15(6-9-26-16)27-11-12-4-7-22-8-5-12/h1-10H,11H2,(H,23,24)