N,N-diethyl-N'-(2-piperidin-1-ylethyl)-N'-[3-(7H-purin-8-yl)phenyl]ethane-1,2-diamine

Systemtic Name: N,N-diethyl-N'-(2-piperidin-1-ylethyl)-N'-[3-(7H-purin-8-yl)phenyl]ethane-1,2-diamine Openeye Name: N,N-diethyl-N'-[2-(1-piperidyl)ethyl]-N'-[3-(7H-purin-8-yl)phenyl]ethane-1,2-diamine CAS Name: N,N-diethyl-N'-[2-(1-piperidinyl)ethyl]-N'-[3-(7H-purin-8-yl)phenyl]ethane-1,2-diamine IUPAC Name: N,N-diethyl-N'-(2-piperidin-1-ylethyl)-N'-[3-(7H-purin-8-yl)phenyl]ethane-1,2-diamine Traditional Name: diethyl-[2-[N-(2-piperidinoethyl)-3-(7H-purin-8-yl)anilino]ethyl]amine Formula: C24H35N7 MolecularWeight: 421.5816

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Descriptors Computed from Structure

Canonical SMILES:

CCN(CC)CCN(CCN1CCCCC1)C2=CC=CC(=C2)C3=NC4=NC=NC=C4N3

Isomeric SMILES

CCN(CC)CCN(CCN1CCCCC1)C2=CC=CC(=C2)C3=NC4=NC=NC=C4N3

InChI

InChI=1S/C24H35N7/c1-3-29(4-2)13-15-31(16-14-30-11-6-5-7-12-30)21-10-8-9-20(17-21)23-27-22-18-25-19-26-24(22)28-23/h8-10,17-19H,3-7,11-16H2,1-2H3,(H,25,26,27,28)