[4-[3-(1-methylpyrazol-4-yl)phenyl]-1-(7H-purin-6-yl)piperidin-4-yl]methanol

Systemtic Name: [4-[3-(1-methylpyrazol-4-yl)phenyl]-1-(7H-purin-6-yl)piperidin-4-yl]methanol Openeye Name: [4-[3-(1-methylpyrazol-4-yl)phenyl]-1-(7H-purin-6-yl)-4-piperidyl]methanol CAS Name: [4-[3-(1-methyl-4-pyrazolyl)phenyl]-1-(7H-purin-6-yl)-4-piperidinyl]methanol IUPAC Name: [4-[3-(1-methylpyrazol-4-yl)phenyl]-1-(7H-purin-6-yl)piperidin-4-yl]methanol Traditional Name: [4-[3-(1-methylpyrazol-4-yl)phenyl]-1-(7H-purin-6-yl)-4-piperidyl]methanol Formula: C21H23N7O MolecularWeight: 389.45362

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CN1C=C(C=N1)C2=CC(=CC=C2)C3(CCN(CC3)C4=NC=NC5=C4NC=N5)CO

Isomeric SMILES

CN1C=C(C=N1)C2=CC(=CC=C2)C3(CCN(CC3)C4=NC=NC5=C4NC=N5)CO

InChI

InChI=1S/C21H23N7O/c1-27-11-16(10-26-27)15-3-2-4-17(9-15)21(12-29)5-7-28(8-6-21)20-18-19(23-13-22-18)24-14-25-20/h2-4,9-11,13-14,29H,5-8,12H2,1H3,(H,22,23,24,25)