2-[4-[2-[(4-methylcyclohexyl)amino]-4-morpholin-4-yl-pyrimidin-5-yl]phenoxy]ethanenitrile

Systemtic Name: 2-[4-[2-[(4-methylcyclohexyl)amino]-4-morpholin-4-yl-pyrimidin-5-yl]phenoxy]ethanenitrile Openeye Name: 2-[4-[2-[(4-methylcyclohexyl)amino]-4-morpholino-pyrimidin-5-yl]phenoxy]acetonitrile CAS Name: 2-[4-[2-[(4-methylcyclohexyl)amino]-4-(4-morpholinyl)-5-pyrimidinyl]phenoxy]acetonitrile IUPAC Name: 2-[4-[2-[(4-methylcyclohexyl)amino]-4-morpholin-4-ylpyrimidin-5-yl]phenoxy]acetonitrile Traditional Name: 2-[4-[2-[(4-methylcyclohexyl)amino]-4-morpholino-pyrimidin-5-yl]phenoxy]acetonitrile Formula: C23H29N5O2 MolecularWeight: 407.50866

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Descriptors Computed from Structure

Canonical SMILES:

CC1CCC(CC1)NC2=NC=C(C(=N2)N3CCOCC3)C4=CC=C(C=C4)OCC#N

Isomeric SMILES

CC1CCC(CC1)NC2=NC=C(C(=N2)N3CCOCC3)C4=CC=C(C=C4)OCC#N

InChI

InChI=1S/C23H29N5O2/c1-17-2-6-19(7-3-17)26-23-25-16-21(22(27-23)28-11-14-29-15-12-28)18-4-8-20(9-5-18)30-13-10-24/h4-5,8-9,16-17,19H,2-3,6-7,11-15H2,1H3,(H,25,26,27)