9-(4-chloranyl-3-methoxy-phenyl)-N-(dicyclopropylmethyl)-2,8-dimethyl-purin-6-amine

Systemtic Name: 9-(4-chloranyl-3-methoxy-phenyl)-N-(dicyclopropylmethyl)-2,8-dimethyl-purin-6-amine Openeye Name: 9-(4-chloro-3-methoxy-phenyl)-N-(dicyclopropylmethyl)-2,8-dimethyl-purin-6-amine CAS Name: 9-(4-chloro-3-methoxyphenyl)-N-(dicyclopropylmethyl)-2,8-dimethyl-6-purinamine IUPAC Name: 9-(4-chloro-3-methoxyphenyl)-N-(dicyclopropylmethyl)-2,8-dimethylpurin-6-amine Traditional Name: [9-(4-chloro-3-methoxy-phenyl)-2,8-dimethyl-purin-6-yl]-(dicyclopropylmethyl)amine Formula: C21H24ClN5O MolecularWeight: 397.90116

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Descriptors Computed from Structure

Canonical SMILES:

CC1=NC2=C(C(=N1)NC(C3CC3)C4CC4)N=C(N2C5=CC(=C(C=C5)Cl)OC)C

Isomeric SMILES

CC1=NC2=C(C(=N1)NC(C3CC3)C4CC4)N=C(N2C5=CC(=C(C=C5)Cl)OC)C

InChI

InChI=1S/C21H24ClN5O/c1-11-23-20(26-18(13-4-5-13)14-6-7-14)19-21(24-11)27(12(2)25-19)15-8-9-16(22)17(10-15)28-3/h8-10,13-14,18H,4-7H2,1-3H3,(H,23,24,26)