2-[azanyl(butan-2-yl)amino]-N-(3-chlorophenyl)-9-ethyl-purin-6-amine

Systemtic Name: 2-[azanyl(butan-2-yl)amino]-N-(3-chlorophenyl)-9-ethyl-purin-6-amine Openeye Name: 2-[amino(sec-butyl)amino]-N-(3-chlorophenyl)-9-ethyl-purin-6-amine CAS Name: 2-[amino(butan-2-yl)amino]-N-(3-chlorophenyl)-9-ethyl-6-purinamine IUPAC Name: 2-[amino(butan-2-yl)amino]-N-(3-chlorophenyl)-9-ethylpurin-6-amine Traditional Name: [2-[amino(sec-butyl)amino]-9-ethyl-purin-6-yl]-(3-chlorophenyl)amine Formula: C17H22ClN7 MolecularWeight: 359.85648

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Descriptors Computed from Structure

Canonical SMILES:

CCC(C)N(C1=NC2=C(C(=N1)NC3=CC(=CC=C3)Cl)N=CN2CC)N

Isomeric SMILES

CCC(C)N(C1=NC2=C(C(=N1)NC3=CC(=CC=C3)Cl)N=CN2CC)N

InChI

InChI=1S/C17H22ClN7/c1-4-11(3)25(19)17-22-15(21-13-8-6-7-12(18)9-13)14-16(23-17)24(5-2)10-20-14/h6-11H,4-5,19H2,1-3H3,(H,21,22,23)