8-(4-methylphenyl)-2-[4-(7H-purin-6-yl)piperazin-1-yl]quinoline

Systemtic Name: 8-(4-methylphenyl)-2-[4-(7H-purin-6-yl)piperazin-1-yl]quinoline Openeye Name: 8-(p-tolyl)-2-[4-(7H-purin-6-yl)piperazin-1-yl]quinoline CAS Name: 8-(4-methylphenyl)-2-[4-(7H-purin-6-yl)-1-piperazinyl]quinoline IUPAC Name: 8-(4-methylphenyl)-2-[4-(7H-purin-6-yl)piperazin-1-yl]quinoline Traditional Name: 8-(p-tolyl)-2-[4-(7H-purin-6-yl)piperazino]quinoline Formula: C25H23N7 MolecularWeight: 421.49702

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC=C(C=C1)C2=CC=CC3=C2N=C(C=C3)N4CCN(CC4)C5=NC=NC6=C5NC=N6

Isomeric SMILES

CC1=CC=C(C=C1)C2=CC=CC3=C2N=C(C=C3)N4CCN(CC4)C5=NC=NC6=C5NC=N6

InChI

InChI=1S/C25H23N7/c1-17-5-7-18(8-6-17)20-4-2-3-19-9-10-21(30-22(19)20)31-11-13-32(14-12-31)25-23-24(27-15-26-23)28-16-29-25/h2-10,15-16H,11-14H2,1H3,(H,26,27,28,29)