2-[[2-chloranyl-7-(phenylmethyl)-6-piperidin-1-yl-purin-8-yl]amino]ethanol

Systemtic Name: 2-[[2-chloranyl-7-(phenylmethyl)-6-piperidin-1-yl-purin-8-yl]amino]ethanol Openeye Name: 2-[[7-benzyl-2-chloro-6-(1-piperidyl)purin-8-yl]amino]ethanol CAS Name: 2-[[2-chloro-7-(phenylmethyl)-6-(1-piperidinyl)-8-purinyl]amino]ethanol IUPAC Name: 2-[(7-benzyl-2-chloro-6-piperidin-1-ylpurin-8-yl)amino]ethanol Traditional Name: 2-[(7-benzyl-2-chloro-6-piperidino-purin-8-yl)amino]ethanol Formula: C19H23ClN6O MolecularWeight: 386.87852

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Descriptors Computed from Structure

Canonical SMILES:

C1CCN(CC1)C2=NC(=NC3=C2N(C(=N3)NCCO)CC4=CC=CC=C4)Cl

Isomeric SMILES

C1CCN(CC1)C2=NC(=NC3=C2N(C(=N3)NCCO)CC4=CC=CC=C4)Cl

InChI

InChI=1S/C19H23ClN6O/c20-18-22-16-15(17(24-18)25-10-5-2-6-11-25)26(19(23-16)21-9-12-27)13-14-7-3-1-4-8-14/h1,3-4,7-8,27H,2,5-6,9-13H2,(H,21,22,23,24)