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

Systemtic Name: N-(2-oxidanylideneoxolan-3-yl)-4-[2-oxidanylidene-3-(3-piperidin-1-ylpropyl)benzimidazol-1-yl]piperidine-1-carbothioamide Openeye Name: 4-[2-oxo-3-[3-(1-piperidyl)propyl]benzimidazol-1-yl]-N-(2-oxotetrahydrofuran-3-yl)piperidine-1-carbothioamide CAS Name: N-(2-oxo-3-oxolanyl)-4-[2-oxo-3-[3-(1-piperidinyl)propyl]-1-benzimidazolyl]-1-piperidinecarbothioamide IUPAC Name: N-(2-oxooxolan-3-yl)-4-[2-oxo-3-(3-piperidin-1-ylpropyl)benzimidazol-1-yl]piperidine-1-carbothioamide Traditional Name: 4-[2-keto-3-(3-piperidinopropyl)benzimidazol-1-yl]-N-(2-ketotetrahydrofuran-3-yl)piperidine-1-carbothioamide Formula: C25H35N5O3S MolecularWeight: 485.6421

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

C1CCN(CC1)CCCN2C3=CC=CC=C3N(C2=O)C4CCN(CC4)C(=S)NC5CCOC5=O

Isomeric SMILES

C1CCN(CC1)CCCN2C3=CC=CC=C3N(C2=O)C4CCN(CC4)C(=S)NC5CCOC5=O

InChI

InChI=1S/C25H35N5O3S/c31-23-20(11-18-33-23)26-24(34)28-16-9-19(10-17-28)30-22-8-3-2-7-21(22)29(25(30)32)15-6-14-27-12-4-1-5-13-27/h2-3,7-8,19-20H,1,4-6,9-18H2,(H,26,34)