4-[(9-pyrazin-2-ylcarbonyl-4,9-diazaspiro[5.5]undecan-4-yl)methyl]benzenecarbonitrile

Systemtic Name: 4-[(9-pyrazin-2-ylcarbonyl-4,9-diazaspiro[5.5]undecan-4-yl)methyl]benzenecarbonitrile Openeye Name: 4-[[9-(pyrazine-2-carbonyl)-4,9-diazaspiro[5.5]undecan-4-yl]methyl]benzonitrile CAS Name: 4-[[9-[oxo(2-pyrazinyl)methyl]-4,9-diazaspiro[5.5]undecan-4-yl]methyl]benzonitrile IUPAC Name: 4-[[9-(pyrazine-2-carbonyl)-4,9-diazaspiro[5.5]undecan-4-yl]methyl]benzonitrile Traditional Name: 4-[(9-pyrazinoyl-4,9-diazaspiro[5.5]undecan-4-yl)methyl]benzonitrile Formula: C22H25N5O MolecularWeight: 375.4668

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Descriptors Computed from Structure

Canonical SMILES:

C1CC2(CCN(CC2)C(=O)C3=NC=CN=C3)CN(C1)CC4=CC=C(C=C4)C#N

Isomeric SMILES

C1CC2(CCN(CC2)C(=O)C3=NC=CN=C3)CN(C1)CC4=CC=C(C=C4)C#N

InChI

InChI=1S/C22H25N5O/c23-14-18-2-4-19(5-3-18)16-26-11-1-6-22(17-26)7-12-27(13-8-22)21(28)20-15-24-9-10-25-20/h2-5,9-10,15H,1,6-8,11-13,16-17H2