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

Systemtic Name: 4-[[2-azanyl-5-[2-(4-propylphenyl)ethynyl]pyrimidin-4-yl]amino]cyclohexan-1-ol Openeye Name: 4-[[2-amino-5-[2-(4-propylphenyl)ethynyl]pyrimidin-4-yl]amino]cyclohexanol CAS Name: 4-[[2-amino-5-[2-(4-propylphenyl)ethynyl]-4-pyrimidinyl]amino]-1-cyclohexanol IUPAC Name: 4-[[2-amino-5-[2-(4-propylphenyl)ethynyl]pyrimidin-4-yl]amino]cyclohexan-1-ol Traditional Name: 4-[[2-amino-5-[2-(4-propylphenyl)ethynyl]pyrimidin-4-yl]amino]cyclohexanol Formula: C21H26N4O MolecularWeight: 350.45734

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Descriptors Computed from Structure

Canonical SMILES:

CCCC1=CC=C(C=C1)C#CC2=CN=C(N=C2NC3CCC(CC3)O)N

Isomeric SMILES

CCCC1=CC=C(C=C1)C#CC2=CN=C(N=C2NC3CCC(CC3)O)N

InChI

InChI=1S/C21H26N4O/c1-2-3-15-4-6-16(7-5-15)8-9-17-14-23-21(22)25-20(17)24-18-10-12-19(26)13-11-18/h4-7,14,18-19,26H,2-3,10-13H2,1H3,(H3,22,23,24,25)