N-(phenylmethyl)-2-[5-(trifluoromethyl)pyridin-2-yl]sulfanyl-butanamide

Systemtic Name: N-(phenylmethyl)-2-[5-(trifluoromethyl)pyridin-2-yl]sulfanyl-butanamide Openeye Name: N-benzyl-2-[[5-(trifluoromethyl)-2-pyridyl]sulfanyl]butanamide CAS Name: N-(phenylmethyl)-2-[[5-(trifluoromethyl)-2-pyridinyl]thio]butanamide IUPAC Name: N-benzyl-2-[5-(trifluoromethyl)pyridin-2-yl]sulfanylbutanamide Traditional Name: N-benzyl-2-[[5-(trifluoromethyl)-2-pyridyl]thio]butyramide Formula: C17H17F3N2OS MolecularWeight: 354.38989

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Descriptors Computed from Structure

Canonical SMILES:

CCC(C(=O)NCC1=CC=CC=C1)SC2=NC=C(C=C2)C(F)(F)F

Isomeric SMILES

CCC(C(=O)NCC1=CC=CC=C1)SC2=NC=C(C=C2)C(F)(F)F

InChI

InChI=1S/C17H17F3N2OS/c1-2-14(16(23)22-10-12-6-4-3-5-7-12)24-15-9-8-13(11-21-15)17(18,19)20/h3-9,11,14H,2,10H2,1H3,(H,22,23)