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

Systemtic Name: N-butyl-1-(4-chlorophenyl)-N-phenyl-pyrazolo[3,4-d]pyrimidin-4-amine Openeye Name: N-butyl-1-(4-chlorophenyl)-N-phenyl-pyrazolo[3,4-d]pyrimidin-4-amine CAS Name: N-butyl-1-(4-chlorophenyl)-N-phenyl-4-pyrazolo[3,4-d]pyrimidinamine IUPAC Name: N-butyl-1-(4-chlorophenyl)-N-phenylpyrazolo[3,4-d]pyrimidin-4-amine Traditional Name: butyl-[1-(4-chlorophenyl)pyrazolo[3,4-d]pyrimidin-4-yl]-phenyl-amine Formula: C21H20ClN5 MolecularWeight: 377.87

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Descriptors Computed from Structure

Canonical SMILES:

CCCCN(C1=CC=CC=C1)C2=NC=NC3=C2C=NN3C4=CC=C(C=C4)Cl

Isomeric SMILES

CCCCN(C1=CC=CC=C1)C2=NC=NC3=C2C=NN3C4=CC=C(C=C4)Cl

InChI

InChI=1S/C21H20ClN5/c1-2-3-13-26(17-7-5-4-6-8-17)20-19-14-25-27(21(19)24-15-23-20)18-11-9-16(22)10-12-18/h4-12,14-15H,2-3,13H2,1H3