[3,5-bis(chloranyl)phenyl]-[4-[6-[(2-chlorophenyl)methylamino]-9-(phenylmethyl)purin-2-yl]piperazin-1-yl]methanone

Systemtic Name: [3,5-bis(chloranyl)phenyl]-[4-[6-[(2-chlorophenyl)methylamino]-9-(phenylmethyl)purin-2-yl]piperazin-1-yl]methanone Openeye Name: [4-[9-benzyl-6-[(2-chlorophenyl)methylamino]purin-2-yl]piperazin-1-yl]-(3,5-dichlorophenyl)methanone CAS Name: [4-[6-[(2-chlorophenyl)methylamino]-9-(phenylmethyl)-2-purinyl]-1-piperazinyl]-(3,5-dichlorophenyl)methanone IUPAC Name: [4-[9-benzyl-6-[(2-chlorophenyl)methylamino]purin-2-yl]piperazin-1-yl]-(3,5-dichlorophenyl)methanone Traditional Name: [4-[9-benzyl-6-[(2-chlorobenzyl)amino]purin-2-yl]piperazino]-(3,5-dichlorophenyl)methanone Formula: C30H26Cl3N7O MolecularWeight: 606.93274

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Descriptors Computed from Structure

Canonical SMILES:

C1CN(CCN1C2=NC3=C(C(=N2)NCC4=CC=CC=C4Cl)N=CN3CC5=CC=CC=C5)C(=O)C6=CC(=CC(=C6)Cl)Cl

Isomeric SMILES

C1CN(CCN1C2=NC3=C(C(=N2)NCC4=CC=CC=C4Cl)N=CN3CC5=CC=CC=C5)C(=O)C6=CC(=CC(=C6)Cl)Cl

InChI

InChI=1S/C30H26Cl3N7O/c31-23-14-22(15-24(32)16-23)29(41)38-10-12-39(13-11-38)30-36-27(34-17-21-8-4-5-9-25(21)33)26-28(37-30)40(19-35-26)18-20-6-2-1-3-7-20/h1-9,14-16,19H,10-13,17-18H2,(H,34,36,37)