4-[2-(2,2-dimethyl-6-oxidanylidene-8-pyridin-4-yl-3,4-dihydropyrimido[1,2-a]pyrimidin-1-yl)-1-oxidanyl-ethyl]benzenecarbonitrile

Systemtic Name: 4-[2-(2,2-dimethyl-6-oxidanylidene-8-pyridin-4-yl-3,4-dihydropyrimido[1,2-a]pyrimidin-1-yl)-1-oxidanyl-ethyl]benzenecarbonitrile Openeye Name: 4-[2-[2,2-dimethyl-6-oxo-8-(4-pyridyl)-3,4-dihydropyrimido[1,2-a]pyrimidin-1-yl]-1-hydroxy-ethyl]benzonitrile CAS Name: 4-[2-(2,2-dimethyl-6-oxo-8-pyridin-4-yl-3,4-dihydropyrimido[1,2-a]pyrimidin-1-yl)-1-hydroxyethyl]benzonitrile IUPAC Name: 4-[2-(2,2-dimethyl-6-oxo-8-pyridin-4-yl-3,4-dihydropyrimido[1,2-a]pyrimidin-1-yl)-1-hydroxyethyl]benzonitrile Traditional Name: 4-[1-hydroxy-2-[6-keto-2,2-dimethyl-8-(4-pyridyl)-3,4-dihydropyrimido[1,2-a]pyrimidin-1-yl]ethyl]benzonitrile Formula: C23H23N5O2 MolecularWeight: 401.46102

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Descriptors Computed from Structure

Canonical SMILES:

CC1(CCN2C(=O)C=C(N=C2N1CC(C3=CC=C(C=C3)C#N)O)C4=CC=NC=C4)C

Isomeric SMILES

CC1(CCN2C(=O)C=C(N=C2N1CC(C3=CC=C(C=C3)C#N)O)C4=CC=NC=C4)C

InChI

InChI=1S/C23H23N5O2/c1-23(2)9-12-27-21(30)13-19(17-7-10-25-11-8-17)26-22(27)28(23)15-20(29)18-5-3-16(14-24)4-6-18/h3-8,10-11,13,20,29H,9,12,15H2,1-2H3