4-[[2-azanyl-5-[2-(4-tert-butylphenyl)ethynyl]pyrimidin-4-yl]amino]cyclohexan-1-ol

Systemtic Name: 4-[[2-azanyl-5-[2-(4-tert-butylphenyl)ethynyl]pyrimidin-4-yl]amino]cyclohexan-1-ol Openeye Name: 4-[[2-amino-5-[2-(4-tert-butylphenyl)ethynyl]pyrimidin-4-yl]amino]cyclohexanol CAS Name: 4-[[2-amino-5-[2-(4-tert-butylphenyl)ethynyl]-4-pyrimidinyl]amino]-1-cyclohexanol IUPAC Name: 4-[[2-amino-5-[2-(4-tert-butylphenyl)ethynyl]pyrimidin-4-yl]amino]cyclohexan-1-ol Traditional Name: 4-[[2-amino-5-[2-(4-tert-butylphenyl)ethynyl]pyrimidin-4-yl]amino]cyclohexanol Formula: C22H28N4O MolecularWeight: 364.48392

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)(C)C1=CC=C(C=C1)C#CC2=CN=C(N=C2NC3CCC(CC3)O)N

Isomeric SMILES

CC(C)(C)C1=CC=C(C=C1)C#CC2=CN=C(N=C2NC3CCC(CC3)O)N

InChI

InChI=1S/C22H28N4O/c1-22(2,3)17-8-5-15(6-9-17)4-7-16-14-24-21(23)26-20(16)25-18-10-12-19(27)13-11-18/h5-6,8-9,14,18-19,27H,10-13H2,1-3H3,(H3,23,24,25,26)