2-[4-[2-(1H-benzimidazol-2-ylsulfanyl)ethyl]piperazin-1-yl]-N-(6-methyl-2,4-dipyrrolidin-1-yl-pyridin-3-yl)ethanamide

Systemtic Name: 2-[4-[2-(1H-benzimidazol-2-ylsulfanyl)ethyl]piperazin-1-yl]-N-(6-methyl-2,4-dipyrrolidin-1-yl-pyridin-3-yl)ethanamide Openeye Name: 2-[4-[2-(1H-benzimidazol-2-ylsulfanyl)ethyl]piperazin-1-yl]-N-(6-methyl-2,4-dipyrrolidin-1-yl-3-pyridyl)acetamide CAS Name: 2-[4-[2-(1H-benzimidazol-2-ylthio)ethyl]-1-piperazinyl]-N-[6-methyl-2,4-bis(1-pyrrolidinyl)-3-pyridinyl]acetamide IUPAC Name: 2-[4-[2-(1H-benzimidazol-2-ylsulfanyl)ethyl]piperazin-1-yl]-N-(6-methyl-2,4-dipyrrolidin-1-ylpyridin-3-yl)acetamide Traditional Name: 2-[4-[2-(1H-benzimidazol-2-ylthio)ethyl]piperazino]-N-(6-methyl-2,4-dipyrrolidino-3-pyridyl)acetamide Formula: C29H40N8OS MolecularWeight: 548.7459

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CC1=NC(=C(C(=C1)N2CCCC2)NC(=O)CN3CCN(CC3)CCSC4=NC5=CC=CC=C5N4)N6CCCC6

Isomeric SMILES

CC1=NC(=C(C(=C1)N2CCCC2)NC(=O)CN3CCN(CC3)CCSC4=NC5=CC=CC=C5N4)N6CCCC6

InChI

InChI=1S/C29H40N8OS/c1-22-20-25(36-10-4-5-11-36)27(28(30-22)37-12-6-7-13-37)33-26(38)21-35-16-14-34(15-17-35)18-19-39-29-31-23-8-2-3-9-24(23)32-29/h2-3,8-9,20H,4-7,10-19,21H2,1H3,(H,31,32)(H,33,38)