2-[4-[5-(3-methyl-1,2-oxazol-5-yl)-2-(3-methylpiperidin-1-yl)pyrimidin-4-yl]piperidin-1-yl]pyridine-3-carbonitrile

Systemtic Name: 2-[4-[5-(3-methyl-1,2-oxazol-5-yl)-2-(3-methylpiperidin-1-yl)pyrimidin-4-yl]piperidin-1-yl]pyridine-3-carbonitrile Openeye Name: 2-[4-[5-(3-methylisoxazol-5-yl)-2-(3-methyl-1-piperidyl)pyrimidin-4-yl]-1-piperidyl]pyridine-3-carbonitrile CAS Name: 2-[4-[5-(3-methyl-5-isoxazolyl)-2-(3-methyl-1-piperidinyl)-4-pyrimidinyl]-1-piperidinyl]-3-pyridinecarbonitrile IUPAC Name: 2-[4-[5-(3-methyl-1,2-oxazol-5-yl)-2-(3-methylpiperidin-1-yl)pyrimidin-4-yl]piperidin-1-yl]pyridine-3-carbonitrile Traditional Name: 2-[4-[5-(3-methylisoxazol-5-yl)-2-(3-methylpiperidino)pyrimidin-4-yl]piperidino]nicotinonitrile Formula: C25H29N7O MolecularWeight: 443.54406

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CC1CCCN(C1)C2=NC=C(C(=N2)C3CCN(CC3)C4=C(C=CC=N4)C#N)C5=CC(=NO5)C

Isomeric SMILES

CC1CCCN(C1)C2=NC=C(C(=N2)C3CCN(CC3)C4=C(C=CC=N4)C#N)C5=CC(=NO5)C

InChI

InChI=1S/C25H29N7O/c1-17-5-4-10-32(16-17)25-28-15-21(22-13-18(2)30-33-22)23(29-25)19-7-11-31(12-8-19)24-20(14-26)6-3-9-27-24/h3,6,9,13,15,17,19H,4-5,7-8,10-12,16H2,1-2H3