N1-[9-[2-(4-aminophenyl)ethyl]purin-6-yl]cyclohexane-1,3-diamine

Systemtic Name: N1-[9-[2-(4-aminophenyl)ethyl]purin-6-yl]cyclohexane-1,3-diamine Openeye Name: N1-[9-[2-(4-aminophenyl)ethyl]purin-6-yl]cyclohexane-1,3-diamine CAS Name: N1-[9-[2-(4-aminophenyl)ethyl]-6-purinyl]cyclohexane-1,3-diamine IUPAC Name: 1-N-[9-[2-(4-aminophenyl)ethyl]purin-6-yl]cyclohexane-1,3-diamine Traditional Name: (3-aminocyclohexyl)-[9-[2-(4-aminophenyl)ethyl]purin-6-yl]amine Formula: C19H25N7 MolecularWeight: 351.4487

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Descriptors Computed from Structure

Canonical SMILES:

C1CC(CC(C1)NC2=NC=NC3=C2N=CN3CCC4=CC=C(C=C4)N)N

Isomeric SMILES

C1CC(CC(C1)NC2=NC=NC3=C2N=CN3CCC4=CC=C(C=C4)N)N

InChI

InChI=1S/C19H25N7/c20-14-6-4-13(5-7-14)8-9-26-12-24-17-18(22-11-23-19(17)26)25-16-3-1-2-15(21)10-16/h4-7,11-12,15-16H,1-3,8-10,20-21H2,(H,22,23,25)