N-butyl-1-[(4-chlorophenyl)methyl]pyrazolo[3,4-d]pyrimidin-4-amine

Systemtic Name: N-butyl-1-[(4-chlorophenyl)methyl]pyrazolo[3,4-d]pyrimidin-4-amine Openeye Name: N-butyl-1-[(4-chlorophenyl)methyl]pyrazolo[3,4-d]pyrimidin-4-amine CAS Name: N-butyl-1-[(4-chlorophenyl)methyl]-4-pyrazolo[3,4-d]pyrimidinamine IUPAC Name: N-butyl-1-[(4-chlorophenyl)methyl]pyrazolo[3,4-d]pyrimidin-4-amine Traditional Name: butyl-[1-(4-chlorobenzyl)pyrazolo[3,4-d]pyrimidin-4-yl]amine Formula: C16H18ClN5 MolecularWeight: 315.80062

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Descriptors Computed from Structure

Canonical SMILES:

CCCCNC1=NC=NC2=C1C=NN2CC3=CC=C(C=C3)Cl

Isomeric SMILES

CCCCNC1=NC=NC2=C1C=NN2CC3=CC=C(C=C3)Cl

InChI

InChI=1S/C16H18ClN5/c1-2-3-8-18-15-14-9-21-22(16(14)20-11-19-15)10-12-4-6-13(17)7-5-12/h4-7,9,11H,2-3,8,10H2,1H3,(H,18,19,20)