N-[4-chloranyl-3-(trifluoromethyl)phenyl]-4-(2-methoxyphenyl)piperidine-1-carbothioamide

Systemtic Name: N-[4-chloranyl-3-(trifluoromethyl)phenyl]-4-(2-methoxyphenyl)piperidine-1-carbothioamide Openeye Name: N-[4-chloro-3-(trifluoromethyl)phenyl]-4-(2-methoxyphenyl)piperidine-1-carbothioamide CAS Name: N-[4-chloro-3-(trifluoromethyl)phenyl]-4-(2-methoxyphenyl)-1-piperidinecarbothioamide IUPAC Name: N-[4-chloro-3-(trifluoromethyl)phenyl]-4-(2-methoxyphenyl)piperidine-1-carbothioamide Traditional Name: N-[4-chloro-3-(trifluoromethyl)phenyl]-4-(2-methoxyphenyl)piperidine-1-carbothioamide Formula: C20H20ClF3N2OS MolecularWeight: 428.89881

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

COC1=CC=CC=C1C2CCN(CC2)C(=S)NC3=CC(=C(C=C3)Cl)C(F)(F)F

Isomeric SMILES

COC1=CC=CC=C1C2CCN(CC2)C(=S)NC3=CC(=C(C=C3)Cl)C(F)(F)F

InChI

InChI=1S/C20H20ClF3N2OS/c1-27-18-5-3-2-4-15(18)13-8-10-26(11-9-13)19(28)25-14-6-7-17(21)16(12-14)20(22,23)24/h2-7,12-13H,8-11H2,1H3,(H,25,28)