3-[4-[(3,4-dimethoxyphenyl)amino]-1-piperidin-4-yl-pyrazolo[3,4-d]pyrimidin-6-yl]phenol

Systemtic Name: 3-[4-[(3,4-dimethoxyphenyl)amino]-1-piperidin-4-yl-pyrazolo[3,4-d]pyrimidin-6-yl]phenol Openeye Name: 3-[4-(3,4-dimethoxyanilino)-1-(4-piperidyl)pyrazolo[3,4-d]pyrimidin-6-yl]phenol CAS Name: 3-[4-(3,4-dimethoxyanilino)-1-(4-piperidinyl)-6-pyrazolo[3,4-d]pyrimidinyl]phenol IUPAC Name: 3-[4-(3,4-dimethoxyanilino)-1-piperidin-4-ylpyrazolo[3,4-d]pyrimidin-6-yl]phenol Traditional Name: 3-[4-(3,4-dimethoxyanilino)-1-(4-piperidyl)pyrazolo[3,4-d]pyrimidin-6-yl]phenol Formula: C24H26N6O3 MolecularWeight: 446.50164

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Descriptors Computed from Structure

Canonical SMILES:

COC1=C(C=C(C=C1)NC2=NC(=NC3=C2C=NN3C4CCNCC4)C5=CC(=CC=C5)O)OC

Isomeric SMILES

COC1=C(C=C(C=C1)NC2=NC(=NC3=C2C=NN3C4CCNCC4)C5=CC(=CC=C5)O)OC

InChI

InChI=1S/C24H26N6O3/c1-32-20-7-6-16(13-21(20)33-2)27-23-19-14-26-30(17-8-10-25-11-9-17)24(19)29-22(28-23)15-4-3-5-18(31)12-15/h3-7,12-14,17,25,31H,8-11H2,1-2H3,(H,27,28,29)