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9-(4-chlorophenyl)-N-[2-(3,4-dimethoxyphenyl)ethyl]purin-6-amine

9-(4-chlorophenyl)-N-[2-(3,4-dimethoxyphenyl)ethyl]purin-6-amine

Systemtic Name:9-(4-chlorophenyl)-N-[2-(3,4-dimethoxyphenyl)ethyl]purin-6-amine
Openeye Name:9-(4-chlorophenyl)-N-[2-(3,4-dimethoxyphenyl)ethyl]purin-6-amine
CAS Name:9-(4-chlorophenyl)-N-[2-(3,4-dimethoxyphenyl)ethyl]-6-purinamine
IUPAC Name:9-(4-chlorophenyl)-N-[2-(3,4-dimethoxyphenyl)ethyl]purin-6-amine
Traditional Name:[9-(4-chlorophenyl)purin-6-yl]-homoveratryl-amine
Formula: C21H20ClN5O2
MolecularWeight: 409.8688
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Descriptors Computed from Structure

Canonical SMILES:

COC1=C(C=C(C=C1)CCNC2=NC=NC3=C2N=CN3C4=CC=C(C=C4)Cl)OC


Isomeric SMILES

COC1=C(C=C(C=C1)CCNC2=NC=NC3=C2N=CN3C4=CC=C(C=C4)Cl)OC


InChI

InChI=1S/C21H20ClN5O2/c1-28-17-8-3-14(11-18(17)29-2)9-10-23-20-19-21(25-12-24-20)27(13-26-19)16-6-4-15(22)5-7-16/h3-8,11-13H,9-10H2,1-2H3,(H,23,24,25)


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