N-[1-(4-fluorophenyl)ethyl]-4-[2-oxidanylidene-3-(3-piperidin-1-ylpropyl)benzimidazol-1-yl]piperidine-1-carbothioamide

Systemtic Name: N-[1-(4-fluorophenyl)ethyl]-4-[2-oxidanylidene-3-(3-piperidin-1-ylpropyl)benzimidazol-1-yl]piperidine-1-carbothioamide Openeye Name: N-[1-(4-fluorophenyl)ethyl]-4-[2-oxo-3-[3-(1-piperidyl)propyl]benzimidazol-1-yl]piperidine-1-carbothioamide CAS Name: N-[1-(4-fluorophenyl)ethyl]-4-[2-oxo-3-[3-(1-piperidinyl)propyl]-1-benzimidazolyl]-1-piperidinecarbothioamide IUPAC Name: N-[1-(4-fluorophenyl)ethyl]-4-[2-oxo-3-(3-piperidin-1-ylpropyl)benzimidazol-1-yl]piperidine-1-carbothioamide Traditional Name: N-[1-(4-fluorophenyl)ethyl]-4-[2-keto-3-(3-piperidinopropyl)benzimidazol-1-yl]piperidine-1-carbothioamide Formula: C29H38FN5OS MolecularWeight: 523.708323

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Descriptors Computed from Structure

Canonical SMILES:

CC(C1=CC=C(C=C1)F)NC(=S)N2CCC(CC2)N3C4=CC=CC=C4N(C3=O)CCCN5CCCCC5

Isomeric SMILES

CC(C1=CC=C(C=C1)F)NC(=S)N2CCC(CC2)N3C4=CC=CC=C4N(C3=O)CCCN5CCCCC5

InChI

InChI=1S/C29H38FN5OS/c1-22(23-10-12-24(30)13-11-23)31-28(37)33-20-14-25(15-21-33)35-27-9-4-3-8-26(27)34(29(35)36)19-7-18-32-16-5-2-6-17-32/h3-4,8-13,22,25H,2,5-7,14-21H2,1H3,(H,31,37)