2-methyl-2-[4-[6-[[(2R)-2-oxidanyl-2-phenyl-ethyl]amino]pyrimidin-4-yl]phenyl]propanenitrile

Systemtic Name: 2-methyl-2-[4-[6-[[(2R)-2-oxidanyl-2-phenyl-ethyl]amino]pyrimidin-4-yl]phenyl]propanenitrile Openeye Name: 2-[4-[6-[[(2R)-2-hydroxy-2-phenyl-ethyl]amino]pyrimidin-4-yl]phenyl]-2-methyl-propanenitrile CAS Name: 2-[4-[6-[[(2R)-2-hydroxy-2-phenylethyl]amino]-4-pyrimidinyl]phenyl]-2-methylpropanenitrile IUPAC Name: 2-[4-[6-[[(2R)-2-hydroxy-2-phenylethyl]amino]pyrimidin-4-yl]phenyl]-2-methylpropanenitrile Traditional Name: 2-[4-[6-[[(2R)-2-hydroxy-2-phenyl-ethyl]amino]pyrimidin-4-yl]phenyl]-2-methyl-propionitrile Formula: C22H22N4O MolecularWeight: 358.43628

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)(C#N)C1=CC=C(C=C1)C2=CC(=NC=N2)NCC(C3=CC=CC=C3)O

Isomeric SMILES

CC(C)(C#N)C1=CC=C(C=C1)C2=CC(=NC=N2)NC[C@@H](C3=CC=CC=C3)O

InChI

InChI=1S/C22H22N4O/c1-22(2,14-23)18-10-8-16(9-11-18)19-12-21(26-15-25-19)24-13-20(27)17-6-4-3-5-7-17/h3-12,15,20,27H,13H2,1-2H3,(H,24,25,26)/t20-/m0/s1