N4-[1-(3-chlorophenyl)pyrazolo[3,4-d]pyrimidin-4-yl]-N1-phenyl-benzene-1,4-diamine

Systemtic Name: N4-[1-(3-chlorophenyl)pyrazolo[3,4-d]pyrimidin-4-yl]-N1-phenyl-benzene-1,4-diamine Openeye Name: N4-[1-(3-chlorophenyl)pyrazolo[3,4-d]pyrimidin-4-yl]-N1-phenyl-benzene-1,4-diamine CAS Name: N4-[1-(3-chlorophenyl)-4-pyrazolo[3,4-d]pyrimidinyl]-N1-phenylbenzene-1,4-diamine IUPAC Name: 4-N-[1-(3-chlorophenyl)pyrazolo[3,4-d]pyrimidin-4-yl]-1-N-phenylbenzene-1,4-diamine Traditional Name: (4-anilinophenyl)-[1-(3-chlorophenyl)pyrazolo[3,4-d]pyrimidin-4-yl]amine Formula: C23H17ClN6 MolecularWeight: 412.87428

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC=C(C=C1)NC2=CC=C(C=C2)NC3=NC=NC4=C3C=NN4C5=CC(=CC=C5)Cl

Isomeric SMILES

C1=CC=C(C=C1)NC2=CC=C(C=C2)NC3=NC=NC4=C3C=NN4C5=CC(=CC=C5)Cl

InChI

InChI=1S/C23H17ClN6/c24-16-5-4-8-20(13-16)30-23-21(14-27-30)22(25-15-26-23)29-19-11-9-18(10-12-19)28-17-6-2-1-3-7-17/h1-15,28H,(H,25,26,29)