3-(5-chloranyl-2-piperidin-1-yl-pyrimidin-4-yl)-3-oxidanylidene-2-pyridin-2-yl-propanenitrile

Systemtic Name: 3-(5-chloranyl-2-piperidin-1-yl-pyrimidin-4-yl)-3-oxidanylidene-2-pyridin-2-yl-propanenitrile Openeye Name: 3-[5-chloro-2-(1-piperidyl)pyrimidin-4-yl]-3-oxo-2-(2-pyridyl)propanenitrile CAS Name: 3-[5-chloro-2-(1-piperidinyl)-4-pyrimidinyl]-3-oxo-2-(2-pyridinyl)propanenitrile IUPAC Name: 3-(5-chloro-2-piperidin-1-ylpyrimidin-4-yl)-3-oxo-2-pyridin-2-ylpropanenitrile Traditional Name: 3-(5-chloro-2-piperidino-pyrimidin-4-yl)-3-keto-2-(2-pyridyl)propionitrile Formula: C17H16ClN5O MolecularWeight: 341.79484

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

C1CCN(CC1)C2=NC=C(C(=N2)C(=O)C(C#N)C3=CC=CC=N3)Cl

Isomeric SMILES

C1CCN(CC1)C2=NC=C(C(=N2)C(=O)C(C#N)C3=CC=CC=N3)Cl

InChI

InChI=1S/C17H16ClN5O/c18-13-11-21-17(23-8-4-1-5-9-23)22-15(13)16(24)12(10-19)14-6-2-3-7-20-14/h2-3,6-7,11-12H,1,4-5,8-9H2