N-[2-[3-chloranyl-5-(trifluoromethyl)pyridin-2-yl]sulfanyl-2-methyl-propyl]-4-methyl-benzamide

Systemtic Name: N-[2-[3-chloranyl-5-(trifluoromethyl)pyridin-2-yl]sulfanyl-2-methyl-propyl]-4-methyl-benzamide Openeye Name: N-[2-[[3-chloro-5-(trifluoromethyl)-2-pyridyl]sulfanyl]-2-methyl-propyl]-4-methyl-benzamide CAS Name: N-[2-[[3-chloro-5-(trifluoromethyl)-2-pyridinyl]thio]-2-methylpropyl]-4-methylbenzamide IUPAC Name: N-[2-[3-chloro-5-(trifluoromethyl)pyridin-2-yl]sulfanyl-2-methylpropyl]-4-methylbenzamide Traditional Name: N-[2-[[3-chloro-5-(trifluoromethyl)-2-pyridyl]thio]-2-methyl-propyl]-4-methyl-benzamide Formula: C18H18ClF3N2OS MolecularWeight: 402.86153

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC=C(C=C1)C(=O)NCC(C)(C)SC2=C(C=C(C=N2)C(F)(F)F)Cl

Isomeric SMILES

CC1=CC=C(C=C1)C(=O)NCC(C)(C)SC2=C(C=C(C=N2)C(F)(F)F)Cl

InChI

InChI=1S/C18H18ClF3N2OS/c1-11-4-6-12(7-5-11)15(25)24-10-17(2,3)26-16-14(19)8-13(9-23-16)18(20,21)22/h4-9H,10H2,1-3H3,(H,24,25)