4-[4-chloranyl-3-(trifluoromethyl)phenyl]sulfonyl-N-[(4-methoxyphenyl)methyl]piperazine-1-carbothioamide

Systemtic Name: 4-[4-chloranyl-3-(trifluoromethyl)phenyl]sulfonyl-N-[(4-methoxyphenyl)methyl]piperazine-1-carbothioamide Openeye Name: 4-[4-chloro-3-(trifluoromethyl)phenyl]sulfonyl-N-[(4-methoxyphenyl)methyl]piperazine-1-carbothioamide CAS Name: 4-[4-chloro-3-(trifluoromethyl)phenyl]sulfonyl-N-[(4-methoxyphenyl)methyl]-1-piperazinecarbothioamide IUPAC Name: 4-[4-chloro-3-(trifluoromethyl)phenyl]sulfonyl-N-[(4-methoxyphenyl)methyl]piperazine-1-carbothioamide Traditional Name: 4-[4-chloro-3-(trifluoromethyl)phenyl]sulfonyl-N-p-anisyl-piperazine-1-carbothioamide Formula: C20H21ClF3N3O3S2 MolecularWeight: 507.97725

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

COC1=CC=C(C=C1)CNC(=S)N2CCN(CC2)S(=O)(=O)C3=CC(=C(C=C3)Cl)C(F)(F)F

Isomeric SMILES

COC1=CC=C(C=C1)CNC(=S)N2CCN(CC2)S(=O)(=O)C3=CC(=C(C=C3)Cl)C(F)(F)F

InChI

InChI=1S/C20H21ClF3N3O3S2/c1-30-15-4-2-14(3-5-15)13-25-19(31)26-8-10-27(11-9-26)32(28,29)16-6-7-18(21)17(12-16)20(22,23)24/h2-7,12H,8-11,13H2,1H3,(H,25,31)