N-(3-chloranyl-4-methoxy-phenyl)-1-methyl-6-(4-phenylpiperazin-1-yl)pyrazolo[3,4-d]pyrimidin-4-amine

Systemtic Name: N-(3-chloranyl-4-methoxy-phenyl)-1-methyl-6-(4-phenylpiperazin-1-yl)pyrazolo[3,4-d]pyrimidin-4-amine Openeye Name: N-(3-chloro-4-methoxy-phenyl)-1-methyl-6-(4-phenylpiperazin-1-yl)pyrazolo[3,4-d]pyrimidin-4-amine CAS Name: N-(3-chloro-4-methoxyphenyl)-1-methyl-6-(4-phenyl-1-piperazinyl)-4-pyrazolo[3,4-d]pyrimidinamine IUPAC Name: N-(3-chloro-4-methoxyphenyl)-1-methyl-6-(4-phenylpiperazin-1-yl)pyrazolo[3,4-d]pyrimidin-4-amine Traditional Name: (3-chloro-4-methoxy-phenyl)-[1-methyl-6-(4-phenylpiperazino)pyrazolo[3,4-d]pyrimidin-4-yl]amine Formula: C23H24ClN7O MolecularWeight: 449.93596

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Descriptors Computed from Structure

Canonical SMILES:

CN1C2=C(C=N1)C(=NC(=N2)N3CCN(CC3)C4=CC=CC=C4)NC5=CC(=C(C=C5)OC)Cl

Isomeric SMILES

CN1C2=C(C=N1)C(=NC(=N2)N3CCN(CC3)C4=CC=CC=C4)NC5=CC(=C(C=C5)OC)Cl

InChI

InChI=1S/C23H24ClN7O/c1-29-22-18(15-25-29)21(26-16-8-9-20(32-2)19(24)14-16)27-23(28-22)31-12-10-30(11-13-31)17-6-4-3-5-7-17/h3-9,14-15H,10-13H2,1-2H3,(H,26,27,28)