N6-(3-chlorophenyl)-N2-(2-dimethylaminoethyl)-9-propan-2-yl-purine-2,6-diamine

Systemtic Name: N6-(3-chlorophenyl)-N2-(2-dimethylaminoethyl)-9-propan-2-yl-purine-2,6-diamine Openeye Name: N6-(3-chlorophenyl)-N2-(2-dimethylaminoethyl)-9-isopropyl-purine-2,6-diamine CAS Name: N6-(3-chlorophenyl)-N2-(2-dimethylaminoethyl)-9-propan-2-ylpurine-2,6-diamine IUPAC Name: 6-N-(3-chlorophenyl)-2-N-(2-dimethylaminoethyl)-9-propan-2-ylpurine-2,6-diamine Traditional Name: 2-[[6-(3-chloroanilino)-9-isopropyl-purin-2-yl]amino]ethyl-dimethyl-amine Formula: C18H24ClN7 MolecularWeight: 373.88306

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)N1C=NC2=C1N=C(N=C2NC3=CC(=CC=C3)Cl)NCCN(C)C

Isomeric SMILES

CC(C)N1C=NC2=C1N=C(N=C2NC3=CC(=CC=C3)Cl)NCCN(C)C

InChI

InChI=1S/C18H24ClN7/c1-12(2)26-11-21-15-16(22-14-7-5-6-13(19)10-14)23-18(24-17(15)26)20-8-9-25(3)4/h5-7,10-12H,8-9H2,1-4H3,(H2,20,22,23,24)