2-[5-methyl-2-[(4-oxidanylcyclohexyl)amino]pyrimidin-4-yl]-2-pyridin-2-yl-ethanenitrile

Systemtic Name: 2-[5-methyl-2-[(4-oxidanylcyclohexyl)amino]pyrimidin-4-yl]-2-pyridin-2-yl-ethanenitrile Openeye Name: 2-[2-[(4-hydroxycyclohexyl)amino]-5-methyl-pyrimidin-4-yl]-2-(2-pyridyl)acetonitrile CAS Name: 2-[2-[(4-hydroxycyclohexyl)amino]-5-methyl-4-pyrimidinyl]-2-(2-pyridinyl)acetonitrile IUPAC Name: 2-[2-[(4-hydroxycyclohexyl)amino]-5-methylpyrimidin-4-yl]-2-pyridin-2-ylacetonitrile Traditional Name: 2-[2-[(4-hydroxycyclohexyl)amino]-5-methyl-pyrimidin-4-yl]-2-(2-pyridyl)acetonitrile Formula: C18H21N5O MolecularWeight: 323.39224

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CN=C(N=C1C(C#N)C2=CC=CC=N2)NC3CCC(CC3)O

Isomeric SMILES

CC1=CN=C(N=C1C(C#N)C2=CC=CC=N2)NC3CCC(CC3)O

InChI

InChI=1S/C18H21N5O/c1-12-11-21-18(22-13-5-7-14(24)8-6-13)23-17(12)15(10-19)16-4-2-3-9-20-16/h2-4,9,11,13-15,24H,5-8H2,1H3,(H,21,22,23)