2-[(4-chlorophenyl)methyl-[5-(trifluoromethyl)pyridin-2-yl]amino]-N-cyclohexyl-4-methyl-pentanethioamide

Systemtic Name: 2-[(4-chlorophenyl)methyl-[5-(trifluoromethyl)pyridin-2-yl]amino]-N-cyclohexyl-4-methyl-pentanethioamide Openeye Name: 2-[(4-chlorophenyl)methyl-[5-(trifluoromethyl)-2-pyridyl]amino]-N-cyclohexyl-4-methyl-pentanethioamide CAS Name: 2-[(4-chlorophenyl)methyl-[5-(trifluoromethyl)-2-pyridinyl]amino]-N-cyclohexyl-4-methylpentanethioamide IUPAC Name: 2-[(4-chlorophenyl)methyl-[5-(trifluoromethyl)pyridin-2-yl]amino]-N-cyclohexyl-4-methylpentanethioamide Traditional Name: 2-[(4-chlorobenzyl)-[5-(trifluoromethyl)-2-pyridyl]amino]-N-cyclohexyl-4-methyl-thiovaleramide Formula: C25H31ClF3N3S MolecularWeight: 498.04695

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)CC(C(=S)NC1CCCCC1)N(CC2=CC=C(C=C2)Cl)C3=NC=C(C=C3)C(F)(F)F

Isomeric SMILES

CC(C)CC(C(=S)NC1CCCCC1)N(CC2=CC=C(C=C2)Cl)C3=NC=C(C=C3)C(F)(F)F

InChI

InChI=1S/C25H31ClF3N3S/c1-17(2)14-22(24(33)31-21-6-4-3-5-7-21)32(16-18-8-11-20(26)12-9-18)23-13-10-19(15-30-23)25(27,28)29/h8-13,15,17,21-22H,3-7,14,16H2,1-2H3,(H,31,33)