N4-[1-(5-methoxy-2,3-dihydro-1H-inden-1-yl)pyrazolo[3,4-d]pyrimidin-6-yl]benzene-1,4-diamine

Systemtic Name: N4-[1-(5-methoxy-2,3-dihydro-1H-inden-1-yl)pyrazolo[3,4-d]pyrimidin-6-yl]benzene-1,4-diamine Openeye Name: N4-[1-(5-methoxyindan-1-yl)pyrazolo[3,4-d]pyrimidin-6-yl]benzene-1,4-diamine CAS Name: N4-[1-(5-methoxy-2,3-dihydro-1H-inden-1-yl)-6-pyrazolo[3,4-d]pyrimidinyl]benzene-1,4-diamine IUPAC Name: 4-N-[1-(5-methoxy-2,3-dihydro-1H-inden-1-yl)pyrazolo[3,4-d]pyrimidin-6-yl]benzene-1,4-diamine Traditional Name: (4-aminophenyl)-[1-(5-methoxyindan-1-yl)pyrazolo[3,4-d]pyrimidin-6-yl]amine Formula: C21H20N6O MolecularWeight: 372.4231

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Descriptors Computed from Structure

Canonical SMILES:

COC1=CC2=C(C=C1)C(CC2)N3C4=NC(=NC=C4C=N3)NC5=CC=C(C=C5)N

Isomeric SMILES

COC1=CC2=C(C=C1)C(CC2)N3C4=NC(=NC=C4C=N3)NC5=CC=C(C=C5)N

InChI

InChI=1S/C21H20N6O/c1-28-17-7-8-18-13(10-17)2-9-19(18)27-20-14(12-24-27)11-23-21(26-20)25-16-5-3-15(22)4-6-16/h3-8,10-12,19H,2,9,22H2,1H3,(H,23,25,26)