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

Systemtic Name: N'-ethyl-N'-(3-methylphenyl)-N-(7H-purin-6-yl)propane-1,3-diamine Openeye Name: N'-ethyl-N'-(m-tolyl)-N-(7H-purin-6-yl)propane-1,3-diamine CAS Name: N'-ethyl-N'-(3-methylphenyl)-N-(7H-purin-6-yl)propane-1,3-diamine IUPAC Name: N'-ethyl-N'-(3-methylphenyl)-N-(7H-purin-6-yl)propane-1,3-diamine Traditional Name: ethyl-(m-tolyl)-[3-(7H-purin-6-ylamino)propyl]amine Formula: C17H22N6 MolecularWeight: 310.39678

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Descriptors Computed from Structure

Canonical SMILES:

CCN(CCCNC1=NC=NC2=C1NC=N2)C3=CC=CC(=C3)C

Isomeric SMILES

CCN(CCCNC1=NC=NC2=C1NC=N2)C3=CC=CC(=C3)C

InChI

InChI=1S/C17H22N6/c1-3-23(14-7-4-6-13(2)10-14)9-5-8-18-16-15-17(20-11-19-15)22-12-21-16/h4,6-7,10-12H,3,5,8-9H2,1-2H3,(H2,18,19,20,21,22)