N2-[2-(2,4-dichlorophenyl)ethyl]-9-propyl-8-pyrazol-1-yl-purine-2,6-diamine

Systemtic Name: N2-[2-(2,4-dichlorophenyl)ethyl]-9-propyl-8-pyrazol-1-yl-purine-2,6-diamine Openeye Name: N2-[2-(2,4-dichlorophenyl)ethyl]-9-propyl-8-pyrazol-1-yl-purine-2,6-diamine CAS Name: N2-[2-(2,4-dichlorophenyl)ethyl]-9-propyl-8-(1-pyrazolyl)purine-2,6-diamine IUPAC Name: 2-N-[2-(2,4-dichlorophenyl)ethyl]-9-propyl-8-pyrazol-1-ylpurine-2,6-diamine Traditional Name: (6-amino-9-propyl-8-pyrazol-1-yl-purin-2-yl)-[2-(2,4-dichlorophenyl)ethyl]amine Formula: C19H20Cl2N8 MolecularWeight: 431.3217

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Descriptors Computed from Structure

Canonical SMILES:

CCCN1C2=C(C(=NC(=N2)NCCC3=C(C=C(C=C3)Cl)Cl)N)N=C1N4C=CC=N4

Isomeric SMILES

CCCN1C2=C(C(=NC(=N2)NCCC3=C(C=C(C=C3)Cl)Cl)N)N=C1N4C=CC=N4

InChI

InChI=1S/C19H20Cl2N8/c1-2-9-28-17-15(25-19(28)29-10-3-7-24-29)16(22)26-18(27-17)23-8-6-12-4-5-13(20)11-14(12)21/h3-5,7,10-11H,2,6,8-9H2,1H3,(H3,22,23,26,27)