4-azanyl-1-[8-(2-chlorophenyl)-9-(4-chlorophenyl)purin-6-yl]piperidine-4-carboxamide

Systemtic Name: 4-azanyl-1-[8-(2-chlorophenyl)-9-(4-chlorophenyl)purin-6-yl]piperidine-4-carboxamide Openeye Name: 4-amino-1-[8-(2-chlorophenyl)-9-(4-chlorophenyl)purin-6-yl]piperidine-4-carboxamide CAS Name: 4-amino-1-[8-(2-chlorophenyl)-9-(4-chlorophenyl)-6-purinyl]-4-piperidinecarboxamide IUPAC Name: 4-amino-1-[8-(2-chlorophenyl)-9-(4-chlorophenyl)purin-6-yl]piperidine-4-carboxamide Traditional Name: 4-amino-1-[8-(2-chlorophenyl)-9-(4-chlorophenyl)purin-6-yl]isonipecotamide Formula: C23H21Cl2N7O MolecularWeight: 482.36514

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Descriptors Computed from Structure

Canonical SMILES:

C1CN(CCC1(C(=O)N)N)C2=NC=NC3=C2N=C(N3C4=CC=C(C=C4)Cl)C5=CC=CC=C5Cl

Isomeric SMILES

C1CN(CCC1(C(=O)N)N)C2=NC=NC3=C2N=C(N3C4=CC=C(C=C4)Cl)C5=CC=CC=C5Cl

InChI

InChI=1S/C23H21Cl2N7O/c24-14-5-7-15(8-6-14)32-19(16-3-1-2-4-17(16)25)30-18-20(28-13-29-21(18)32)31-11-9-23(27,10-12-31)22(26)33/h1-8,13H,9-12,27H2,(H2,26,33)