N-[(4-chlorophenyl)methyl]-2-[3-cyano-6-methyl-4-(trifluoromethyl)pyridin-2-yl]sulfanyl-propanamide

Systemtic Name: N-[(4-chlorophenyl)methyl]-2-[3-cyano-6-methyl-4-(trifluoromethyl)pyridin-2-yl]sulfanyl-propanamide Openeye Name: N-[(4-chlorophenyl)methyl]-2-[[3-cyano-6-methyl-4-(trifluoromethyl)-2-pyridyl]sulfanyl]propanamide CAS Name: N-[(4-chlorophenyl)methyl]-2-[[3-cyano-6-methyl-4-(trifluoromethyl)-2-pyridinyl]thio]propanamide IUPAC Name: N-[(4-chlorophenyl)methyl]-2-[3-cyano-6-methyl-4-(trifluoromethyl)pyridin-2-yl]sulfanylpropanamide Traditional Name: N-(4-chlorobenzyl)-2-[[3-cyano-6-methyl-4-(trifluoromethyl)-2-pyridyl]thio]propionamide Formula: C18H15ClF3N3OS MolecularWeight: 413.84441

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Descriptors Computed from Structure

Canonical SMILES:

CC1=NC(=C(C(=C1)C(F)(F)F)C#N)SC(C)C(=O)NCC2=CC=C(C=C2)Cl

Isomeric SMILES

CC1=NC(=C(C(=C1)C(F)(F)F)C#N)SC(C)C(=O)NCC2=CC=C(C=C2)Cl

InChI

InChI=1S/C18H15ClF3N3OS/c1-10-7-15(18(20,21)22)14(8-23)17(25-10)27-11(2)16(26)24-9-12-3-5-13(19)6-4-12/h3-7,11H,9H2,1-2H3,(H,24,26)