1-[4-phenyl-1-(7H-purin-6-yl)piperidin-4-yl]ethanone

Systemtic Name: 1-[4-phenyl-1-(7H-purin-6-yl)piperidin-4-yl]ethanone Openeye Name: 1-[4-phenyl-1-(7H-purin-6-yl)-4-piperidyl]ethanone CAS Name: 1-[4-phenyl-1-(7H-purin-6-yl)-4-piperidinyl]ethanone IUPAC Name: 1-[4-phenyl-1-(7H-purin-6-yl)piperidin-4-yl]ethanone Traditional Name: 1-[4-phenyl-1-(7H-purin-6-yl)-4-piperidyl]ethanone Formula: C18H19N5O MolecularWeight: 321.37636

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Descriptors Computed from Structure

Canonical SMILES:

CC(=O)C1(CCN(CC1)C2=NC=NC3=C2NC=N3)C4=CC=CC=C4

Isomeric SMILES

CC(=O)C1(CCN(CC1)C2=NC=NC3=C2NC=N3)C4=CC=CC=C4

InChI

InChI=1S/C18H19N5O/c1-13(24)18(14-5-3-2-4-6-14)7-9-23(10-8-18)17-15-16(20-11-19-15)21-12-22-17/h2-6,11-12H,7-10H2,1H3,(H,19,20,21,22)