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

Systemtic Name: N-tert-butyl-2-[(4-chlorophenyl)methyl-[5-(trifluoromethyl)pyridin-2-yl]amino]-4-methyl-pentanethioamide Openeye Name: N-tert-butyl-2-[(4-chlorophenyl)methyl-[5-(trifluoromethyl)-2-pyridyl]amino]-4-methyl-pentanethioamide CAS Name: N-tert-butyl-2-[(4-chlorophenyl)methyl-[5-(trifluoromethyl)-2-pyridinyl]amino]-4-methylpentanethioamide IUPAC Name: N-tert-butyl-2-[(4-chlorophenyl)methyl-[5-(trifluoromethyl)pyridin-2-yl]amino]-4-methylpentanethioamide Traditional Name: N-tert-butyl-2-[(4-chlorobenzyl)-[5-(trifluoromethyl)-2-pyridyl]amino]-4-methyl-thiovaleramide Formula: C23H29ClF3N3S MolecularWeight: 472.00967

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)CC(C(=S)NC(C)(C)C)N(CC1=CC=C(C=C1)Cl)C2=NC=C(C=C2)C(F)(F)F

Isomeric SMILES

CC(C)CC(C(=S)NC(C)(C)C)N(CC1=CC=C(C=C1)Cl)C2=NC=C(C=C2)C(F)(F)F

InChI

InChI=1S/C23H29ClF3N3S/c1-15(2)12-19(21(31)29-22(3,4)5)30(14-16-6-9-18(24)10-7-16)20-11-8-17(13-28-20)23(25,26)27/h6-11,13,15,19H,12,14H2,1-5H3,(H,29,31)