N'-(3-methylphenyl)-N'-(7H-purin-6-yl)propane-1,3-diamine

Systemtic Name: N'-(3-methylphenyl)-N'-(7H-purin-6-yl)propane-1,3-diamine Openeye Name: N'-(m-tolyl)-N'-(7H-purin-6-yl)propane-1,3-diamine CAS Name: N'-(3-methylphenyl)-N'-(7H-purin-6-yl)propane-1,3-diamine IUPAC Name: N'-(3-methylphenyl)-N'-(7H-purin-6-yl)propane-1,3-diamine Traditional Name: 3-aminopropyl-(m-tolyl)-(7H-purin-6-yl)amine Formula: C15H18N6 MolecularWeight: 282.34362

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC(=CC=C1)N(CCCN)C2=NC=NC3=C2NC=N3

Isomeric SMILES

CC1=CC(=CC=C1)N(CCCN)C2=NC=NC3=C2NC=N3

InChI

InChI=1S/C15H18N6/c1-11-4-2-5-12(8-11)21(7-3-6-16)15-13-14(18-9-17-13)19-10-20-15/h2,4-5,8-10H,3,6-7,16H2,1H3,(H,17,18,19,20)