4-phenyl-1-[4-(7H-purin-6-yl)piperazin-1-yl]butan-1-one

Systemtic Name: 4-phenyl-1-[4-(7H-purin-6-yl)piperazin-1-yl]butan-1-one Openeye Name: 4-phenyl-1-[4-(7H-purin-6-yl)piperazin-1-yl]butan-1-one CAS Name: 4-phenyl-1-[4-(7H-purin-6-yl)-1-piperazinyl]-1-butanone IUPAC Name: 4-phenyl-1-[4-(7H-purin-6-yl)piperazin-1-yl]butan-1-one Traditional Name: 4-phenyl-1-[4-(7H-purin-6-yl)piperazino]butan-1-one Formula: C19H22N6O MolecularWeight: 350.41758

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Descriptors Computed from Structure

Canonical SMILES:

C1CN(CCN1C2=NC=NC3=C2NC=N3)C(=O)CCCC4=CC=CC=C4

Isomeric SMILES

C1CN(CCN1C2=NC=NC3=C2NC=N3)C(=O)CCCC4=CC=CC=C4

InChI

InChI=1S/C19H22N6O/c26-16(8-4-7-15-5-2-1-3-6-15)24-9-11-25(12-10-24)19-17-18(21-13-20-17)22-14-23-19/h1-3,5-6,13-14H,4,7-12H2,(H,20,21,22,23)