N-(3,4-dichlorophenyl)-2-(3,5-dimethylpyrazol-1-yl)-9-ethyl-purin-6-amine

Systemtic Name: N-(3,4-dichlorophenyl)-2-(3,5-dimethylpyrazol-1-yl)-9-ethyl-purin-6-amine Openeye Name: N-(3,4-dichlorophenyl)-2-(3,5-dimethylpyrazol-1-yl)-9-ethyl-purin-6-amine CAS Name: N-(3,4-dichlorophenyl)-2-(3,5-dimethyl-1-pyrazolyl)-9-ethyl-6-purinamine IUPAC Name: N-(3,4-dichlorophenyl)-2-(3,5-dimethylpyrazol-1-yl)-9-ethylpurin-6-amine Traditional Name: (3,4-dichlorophenyl)-[2-(3,5-dimethylpyrazol-1-yl)-9-ethyl-purin-6-yl]amine Formula: C18H17Cl2N7 MolecularWeight: 402.28048

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Descriptors Computed from Structure

Canonical SMILES:

CCN1C=NC2=C1N=C(N=C2NC3=CC(=C(C=C3)Cl)Cl)N4C(=CC(=N4)C)C

Isomeric SMILES

CCN1C=NC2=C1N=C(N=C2NC3=CC(=C(C=C3)Cl)Cl)N4C(=CC(=N4)C)C

InChI

InChI=1S/C18H17Cl2N7/c1-4-26-9-21-15-16(22-12-5-6-13(19)14(20)8-12)23-18(24-17(15)26)27-11(3)7-10(2)25-27/h5-9H,4H2,1-3H3,(H,22,23,24)