3-[1-(oxan-4-yl)piperidin-4-yl]-2-oxidanylidene-1H-benzimidazole-5-carbonitrile

Systemtic Name: 3-[1-(oxan-4-yl)piperidin-4-yl]-2-oxidanylidene-1H-benzimidazole-5-carbonitrile Openeye Name: 2-oxo-3-(1-tetrahydropyran-4-yl-4-piperidyl)-1H-benzimidazole-5-carbonitrile CAS Name: 3-[1-(4-oxanyl)-4-piperidinyl]-2-oxo-1H-benzimidazole-5-carbonitrile IUPAC Name: 3-[1-(oxan-4-yl)piperidin-4-yl]-2-oxo-1H-benzimidazole-5-carbonitrile Traditional Name: 2-keto-3-(1-tetrahydropyran-4-yl-4-piperidyl)-1H-benzimidazole-5-carbonitrile Formula: C18H22N4O2 MolecularWeight: 326.39288

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

C1CN(CCC1N2C3=C(C=CC(=C3)C#N)NC2=O)C4CCOCC4

Isomeric SMILES

C1CN(CCC1N2C3=C(C=CC(=C3)C#N)NC2=O)C4CCOCC4

InChI

InChI=1S/C18H22N4O2/c19-12-13-1-2-16-17(11-13)22(18(23)20-16)15-3-7-21(8-4-15)14-5-9-24-10-6-14/h1-2,11,14-15H,3-10H2,(H,20,23)