[1-[1-[[4-(2-pyrimidin-5-ylethynyl)phenyl]methyl]piperidin-3-yl]piperidin-4-yl]methanol

Systemtic Name: [1-[1-[[4-(2-pyrimidin-5-ylethynyl)phenyl]methyl]piperidin-3-yl]piperidin-4-yl]methanol Openeye Name: [1-[1-[[4-(2-pyrimidin-5-ylethynyl)phenyl]methyl]-3-piperidyl]-4-piperidyl]methanol CAS Name: [1-[1-[[4-[2-(5-pyrimidinyl)ethynyl]phenyl]methyl]-3-piperidinyl]-4-piperidinyl]methanol IUPAC Name: [1-[1-[[4-(2-pyrimidin-5-ylethynyl)phenyl]methyl]piperidin-3-yl]piperidin-4-yl]methanol Traditional Name: [1-[1-[4-[2-(5-pyrimidyl)ethynyl]benzyl]-3-piperidyl]-4-piperidyl]methanol Formula: C24H30N4O MolecularWeight: 390.5212

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Descriptors Computed from Structure

Canonical SMILES:

C1CC(CN(C1)CC2=CC=C(C=C2)C#CC3=CN=CN=C3)N4CCC(CC4)CO

Isomeric SMILES

C1CC(CN(C1)CC2=CC=C(C=C2)C#CC3=CN=CN=C3)N4CCC(CC4)CO

InChI

InChI=1S/C24H30N4O/c29-18-22-9-12-28(13-10-22)24-2-1-11-27(17-24)16-21-6-3-20(4-7-21)5-8-23-14-25-19-26-15-23/h3-4,6-7,14-15,19,22,24,29H,1-2,9-13,16-18H2