N-[2-(3,4-dimethoxyphenyl)ethyl]-1-phenyl-pyrazolo[3,4-d]pyrimidin-4-amine

Systemtic Name: N-[2-(3,4-dimethoxyphenyl)ethyl]-1-phenyl-pyrazolo[3,4-d]pyrimidin-4-amine Openeye Name: N-[2-(3,4-dimethoxyphenyl)ethyl]-1-phenyl-pyrazolo[3,4-d]pyrimidin-4-amine CAS Name: N-[2-(3,4-dimethoxyphenyl)ethyl]-1-phenyl-4-pyrazolo[3,4-d]pyrimidinamine IUPAC Name: N-[2-(3,4-dimethoxyphenyl)ethyl]-1-phenylpyrazolo[3,4-d]pyrimidin-4-amine Traditional Name: homoveratryl-(1-phenylpyrazolo[3,4-d]pyrimidin-4-yl)amine Formula: C21H21N5O2 MolecularWeight: 375.42374

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Descriptors Computed from Structure

Canonical SMILES:

COC1=C(C=C(C=C1)CCNC2=NC=NC3=C2C=NN3C4=CC=CC=C4)OC

Isomeric SMILES

COC1=C(C=C(C=C1)CCNC2=NC=NC3=C2C=NN3C4=CC=CC=C4)OC

InChI

InChI=1S/C21H21N5O2/c1-27-18-9-8-15(12-19(18)28-2)10-11-22-20-17-13-25-26(21(17)24-14-23-20)16-6-4-3-5-7-16/h3-9,12-14H,10-11H2,1-2H3,(H,22,23,24)