3-chloranyl-1-(2,4-dichlorophenyl)-N-heptan-4-yl-6-methyl-pyrazolo[3,4-d]pyrimidin-4-amine

Systemtic Name: 3-chloranyl-1-(2,4-dichlorophenyl)-N-heptan-4-yl-6-methyl-pyrazolo[3,4-d]pyrimidin-4-amine Openeye Name: 3-chloro-1-(2,4-dichlorophenyl)-6-methyl-N-(1-propylbutyl)pyrazolo[3,4-d]pyrimidin-4-amine CAS Name: 3-chloro-1-(2,4-dichlorophenyl)-N-heptan-4-yl-6-methyl-4-pyrazolo[3,4-d]pyrimidinamine IUPAC Name: 3-chloro-1-(2,4-dichlorophenyl)-N-heptan-4-yl-6-methylpyrazolo[3,4-d]pyrimidin-4-amine Traditional Name: [3-chloro-1-(2,4-dichlorophenyl)-6-methyl-pyrazolo[3,4-d]pyrimidin-4-yl]-(1-propylbutyl)amine Formula: C19H22Cl3N5 MolecularWeight: 426.77048

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Descriptors Computed from Structure

Canonical SMILES:

CCCC(CCC)NC1=NC(=NC2=C1C(=NN2C3=C(C=C(C=C3)Cl)Cl)Cl)C

Isomeric SMILES

CCCC(CCC)NC1=NC(=NC2=C1C(=NN2C3=C(C=C(C=C3)Cl)Cl)Cl)C

InChI

InChI=1S/C19H22Cl3N5/c1-4-6-13(7-5-2)25-18-16-17(22)26-27(19(16)24-11(3)23-18)15-9-8-12(20)10-14(15)21/h8-10,13H,4-7H2,1-3H3,(H,23,24,25)