1-ethyl-3-piperidin-4-yl-4-(1-pyrazin-2-ylcarbonylazepan-4-yl)benzimidazol-2-one

Systemtic Name: 1-ethyl-3-piperidin-4-yl-4-(1-pyrazin-2-ylcarbonylazepan-4-yl)benzimidazol-2-one Openeye Name: 1-ethyl-3-(4-piperidyl)-4-[1-(pyrazine-2-carbonyl)azepan-4-yl]benzimidazol-2-one CAS Name: 1-ethyl-4-[1-[oxo(2-pyrazinyl)methyl]-4-azepanyl]-3-(4-piperidinyl)-2-benzimidazolone IUPAC Name: 1-ethyl-3-piperidin-4-yl-4-[1-(pyrazine-2-carbonyl)azepan-4-yl]benzimidazol-2-one Traditional Name: 1-ethyl-3-(4-piperidyl)-4-(1-pyrazinoylazepan-4-yl)benzimidazol-2-one Formula: C25H32N6O2 MolecularWeight: 448.56058

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CCN1C2=CC=CC(=C2N(C1=O)C3CCNCC3)C4CCCN(CC4)C(=O)C5=NC=CN=C5

Isomeric SMILES

CCN1C2=CC=CC(=C2N(C1=O)C3CCNCC3)C4CCCN(CC4)C(=O)C5=NC=CN=C5

InChI

InChI=1S/C25H32N6O2/c1-2-30-22-7-3-6-20(23(22)31(25(30)33)19-8-11-26-12-9-19)18-5-4-15-29(16-10-18)24(32)21-17-27-13-14-28-21/h3,6-7,13-14,17-19,26H,2,4-5,8-12,15-16H2,1H3