4-(5-chloranyl-2-methyl-phenyl)-N-[4-(trifluoromethyl)phenyl]piperazine-1-carbothioamide

Systemtic Name: 4-(5-chloranyl-2-methyl-phenyl)-N-[4-(trifluoromethyl)phenyl]piperazine-1-carbothioamide Openeye Name: 4-(5-chloro-2-methyl-phenyl)-N-[4-(trifluoromethyl)phenyl]piperazine-1-carbothioamide CAS Name: 4-(5-chloro-2-methylphenyl)-N-[4-(trifluoromethyl)phenyl]-1-piperazinecarbothioamide IUPAC Name: 4-(5-chloro-2-methylphenyl)-N-[4-(trifluoromethyl)phenyl]piperazine-1-carbothioamide Traditional Name: 4-(5-chloro-2-methyl-phenyl)-N-[4-(trifluoromethyl)phenyl]piperazine-1-carbothioamide Formula: C19H19ClF3N3S MolecularWeight: 413.88747

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C(C=C(C=C1)Cl)N2CCN(CC2)C(=S)NC3=CC=C(C=C3)C(F)(F)F

Isomeric SMILES

CC1=C(C=C(C=C1)Cl)N2CCN(CC2)C(=S)NC3=CC=C(C=C3)C(F)(F)F

InChI

InChI=1S/C19H19ClF3N3S/c1-13-2-5-15(20)12-17(13)25-8-10-26(11-9-25)18(27)24-16-6-3-14(4-7-16)19(21,22)23/h2-7,12H,8-11H2,1H3,(H,24,27)