[4-(2-chloranyl-7H-purin-6-yl)piperazin-1-yl]-phenyl-methanone

Systemtic Name: [4-(2-chloranyl-7H-purin-6-yl)piperazin-1-yl]-phenyl-methanone Openeye Name: [4-(2-chloro-7H-purin-6-yl)piperazin-1-yl]-phenyl-methanone CAS Name: [4-(2-chloro-7H-purin-6-yl)-1-piperazinyl]-phenylmethanone IUPAC Name: [4-(2-chloro-7H-purin-6-yl)piperazin-1-yl]-phenylmethanone Traditional Name: [4-(2-chloro-7H-purin-6-yl)piperazino]-phenyl-methanone Formula: C16H15ClN6O MolecularWeight: 342.7829

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Descriptors Computed from Structure

Canonical SMILES:

C1CN(CCN1C2=NC(=NC3=C2NC=N3)Cl)C(=O)C4=CC=CC=C4

Isomeric SMILES

C1CN(CCN1C2=NC(=NC3=C2NC=N3)Cl)C(=O)C4=CC=CC=C4

InChI

InChI=1S/C16H15ClN6O/c17-16-20-13-12(18-10-19-13)14(21-16)22-6-8-23(9-7-22)15(24)11-4-2-1-3-5-11/h1-5,10H,6-9H2,(H,18,19,20,21)