(4-chlorophenyl)-[1-(7H-purin-6-yl)piperidin-4-yl]methanone

Systemtic Name: (4-chlorophenyl)-[1-(7H-purin-6-yl)piperidin-4-yl]methanone Openeye Name: (4-chlorophenyl)-[1-(7H-purin-6-yl)-4-piperidyl]methanone CAS Name: (4-chlorophenyl)-[1-(7H-purin-6-yl)-4-piperidinyl]methanone IUPAC Name: (4-chlorophenyl)-[1-(7H-purin-6-yl)piperidin-4-yl]methanone Traditional Name: (4-chlorophenyl)-[1-(7H-purin-6-yl)-4-piperidyl]methanone Formula: C17H16ClN5O MolecularWeight: 341.79484

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Descriptors Computed from Structure

Canonical SMILES:

C1CN(CCC1C(=O)C2=CC=C(C=C2)Cl)C3=NC=NC4=C3NC=N4

Isomeric SMILES

C1CN(CCC1C(=O)C2=CC=C(C=C2)Cl)C3=NC=NC4=C3NC=N4

InChI

InChI=1S/C17H16ClN5O/c18-13-3-1-11(2-4-13)15(24)12-5-7-23(8-6-12)17-14-16(20-9-19-14)21-10-22-17/h1-4,9-10,12H,5-8H2,(H,19,20,21,22)