N-[4-chloranyl-3-(trifluoromethyl)phenyl]-4-(2-oxidanylidene-3H-benzimidazol-1-yl)piperidine-1-carbothioamide

Systemtic Name: N-[4-chloranyl-3-(trifluoromethyl)phenyl]-4-(2-oxidanylidene-3H-benzimidazol-1-yl)piperidine-1-carbothioamide Openeye Name: N-[4-chloro-3-(trifluoromethyl)phenyl]-4-(2-oxo-3H-benzimidazol-1-yl)piperidine-1-carbothioamide CAS Name: N-[4-chloro-3-(trifluoromethyl)phenyl]-4-(2-oxo-3H-benzimidazol-1-yl)-1-piperidinecarbothioamide IUPAC Name: N-[4-chloro-3-(trifluoromethyl)phenyl]-4-(2-oxo-3H-benzimidazol-1-yl)piperidine-1-carbothioamide Traditional Name: N-[4-chloro-3-(trifluoromethyl)phenyl]-4-(2-keto-3H-benzimidazol-1-yl)piperidine-1-carbothioamide Formula: C20H18ClF3N4OS MolecularWeight: 454.89633

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Descriptors Computed from Structure

Canonical SMILES:

C1CN(CCC1N2C3=CC=CC=C3NC2=O)C(=S)NC4=CC(=C(C=C4)Cl)C(F)(F)F

Isomeric SMILES

C1CN(CCC1N2C3=CC=CC=C3NC2=O)C(=S)NC4=CC(=C(C=C4)Cl)C(F)(F)F

InChI

InChI=1S/C20H18ClF3N4OS/c21-15-6-5-12(11-14(15)20(22,23)24)25-19(30)27-9-7-13(8-10-27)28-17-4-2-1-3-16(17)26-18(28)29/h1-6,11,13H,7-10H2,(H,25,30)(H,26,29)