N-[3-(phenylmethylsulfanyl)propyl]-4-(trifluoromethyl)pyridine-3-carboxamide

Systemtic Name: N-[3-(phenylmethylsulfanyl)propyl]-4-(trifluoromethyl)pyridine-3-carboxamide Openeye Name: N-(3-benzylsulfanylpropyl)-4-(trifluoromethyl)pyridine-3-carboxamide CAS Name: N-[3-(phenylmethylthio)propyl]-4-(trifluoromethyl)-3-pyridinecarboxamide IUPAC Name: N-(3-benzylsulfanylpropyl)-4-(trifluoromethyl)pyridine-3-carboxamide Traditional Name: N-[3-(benzylthio)propyl]-4-(trifluoromethyl)nicotinamide Formula: C17H17F3N2OS MolecularWeight: 354.38989

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC=C(C=C1)CSCCCNC(=O)C2=C(C=CN=C2)C(F)(F)F

Isomeric SMILES

C1=CC=C(C=C1)CSCCCNC(=O)C2=C(C=CN=C2)C(F)(F)F

InChI

InChI=1S/C17H17F3N2OS/c18-17(19,20)15-7-9-21-11-14(15)16(23)22-8-4-10-24-12-13-5-2-1-3-6-13/h1-3,5-7,9,11H,4,8,10,12H2,(H,22,23)