6-(4-methyl-1,4-diazepan-1-yl)-2-phenyl-8-pyridin-4-yl-7H-purine

Systemtic Name: 6-(4-methyl-1,4-diazepan-1-yl)-2-phenyl-8-pyridin-4-yl-7H-purine Openeye Name: 6-(4-methyl-1,4-diazepan-1-yl)-2-phenyl-8-(4-pyridyl)-7H-purine CAS Name: 6-(4-methyl-1,4-diazepan-1-yl)-2-phenyl-8-pyridin-4-yl-7H-purine IUPAC Name: 6-(4-methyl-1,4-diazepan-1-yl)-2-phenyl-8-pyridin-4-yl-7H-purine Traditional Name: 6-(4-methyl-1,4-diazepan-1-yl)-2-phenyl-8-(4-pyridyl)-7H-purine Formula: C22H23N7 MolecularWeight: 385.46492

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Descriptors Computed from Structure

Canonical SMILES:

CN1CCCN(CC1)C2=NC(=NC3=C2NC(=N3)C4=CC=NC=C4)C5=CC=CC=C5

Isomeric SMILES

CN1CCCN(CC1)C2=NC(=NC3=C2NC(=N3)C4=CC=NC=C4)C5=CC=CC=C5

InChI

InChI=1S/C22H23N7/c1-28-12-5-13-29(15-14-28)22-18-21(25-19(24-18)17-8-10-23-11-9-17)26-20(27-22)16-6-3-2-4-7-16/h2-4,6-11H,5,12-15H2,1H3,(H,24,25,26,27)