2-[2-[(2,3-dimethylcyclohexyl)amino]-5-methyl-pyrimidin-4-yl]-2-pyridin-2-yl-ethanenitrile

Systemtic Name: 2-[2-[(2,3-dimethylcyclohexyl)amino]-5-methyl-pyrimidin-4-yl]-2-pyridin-2-yl-ethanenitrile Openeye Name: 2-[2-[(2,3-dimethylcyclohexyl)amino]-5-methyl-pyrimidin-4-yl]-2-(2-pyridyl)acetonitrile CAS Name: 2-[2-[(2,3-dimethylcyclohexyl)amino]-5-methyl-4-pyrimidinyl]-2-(2-pyridinyl)acetonitrile IUPAC Name: 2-[2-[(2,3-dimethylcyclohexyl)amino]-5-methylpyrimidin-4-yl]-2-pyridin-2-ylacetonitrile Traditional Name: 2-[2-[(2,3-dimethylcyclohexyl)amino]-5-methyl-pyrimidin-4-yl]-2-(2-pyridyl)acetonitrile Formula: C20H25N5 MolecularWeight: 335.446

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Descriptors Computed from Structure

Canonical SMILES:

CC1CCCC(C1C)NC2=NC=C(C(=N2)C(C#N)C3=CC=CC=N3)C

Isomeric SMILES

CC1CCCC(C1C)NC2=NC=C(C(=N2)C(C#N)C3=CC=CC=N3)C

InChI

InChI=1S/C20H25N5/c1-13-7-6-9-17(15(13)3)24-20-23-12-14(2)19(25-20)16(11-21)18-8-4-5-10-22-18/h4-5,8,10,12-13,15-17H,6-7,9H2,1-3H3,(H,23,24,25)