2-[[4-[(4-ethoxyphenyl)amino]-1-phenyl-pyrazolo[3,4-d]pyrimidin-6-yl]amino]ethanol

Systemtic Name: 2-[[4-[(4-ethoxyphenyl)amino]-1-phenyl-pyrazolo[3,4-d]pyrimidin-6-yl]amino]ethanol Openeye Name: 2-[[4-(4-ethoxyanilino)-1-phenyl-pyrazolo[3,4-d]pyrimidin-6-yl]amino]ethanol CAS Name: 2-[[4-(4-ethoxyanilino)-1-phenyl-6-pyrazolo[3,4-d]pyrimidinyl]amino]ethanol IUPAC Name: 2-[[4-(4-ethoxyanilino)-1-phenylpyrazolo[3,4-d]pyrimidin-6-yl]amino]ethanol Traditional Name: 2-[[1-phenyl-4-(p-phenetidino)pyrazolo[3,4-d]pyrimidin-6-yl]amino]ethanol Formula: C21H22N6O2 MolecularWeight: 390.43838

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Descriptors Computed from Structure

Canonical SMILES:

CCOC1=CC=C(C=C1)NC2=NC(=NC3=C2C=NN3C4=CC=CC=C4)NCCO

Isomeric SMILES

CCOC1=CC=C(C=C1)NC2=NC(=NC3=C2C=NN3C4=CC=CC=C4)NCCO

InChI

InChI=1S/C21H22N6O2/c1-2-29-17-10-8-15(9-11-17)24-19-18-14-23-27(16-6-4-3-5-7-16)20(18)26-21(25-19)22-12-13-28/h3-11,14,28H,2,12-13H2,1H3,(H2,22,24,25,26)