2-azanyl-1-(1H-indol-3-yl)-3-[(4-pyridin-4-ylpyrimidin-2-yl)amino]propan-1-ol

Systemtic Name: 2-azanyl-1-(1H-indol-3-yl)-3-[(4-pyridin-4-ylpyrimidin-2-yl)amino]propan-1-ol Openeye Name: 2-amino-1-(1H-indol-3-yl)-3-[[4-(4-pyridyl)pyrimidin-2-yl]amino]propan-1-ol CAS Name: 2-amino-1-(1H-indol-3-yl)-3-[(4-pyridin-4-yl-2-pyrimidinyl)amino]-1-propanol IUPAC Name: 2-amino-1-(1H-indol-3-yl)-3-[(4-pyridin-4-ylpyrimidin-2-yl)amino]propan-1-ol Traditional Name: 2-amino-1-(1H-indol-3-yl)-3-[[4-(4-pyridyl)pyrimidin-2-yl]amino]propan-1-ol Formula: C20H20N6O MolecularWeight: 360.4124

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC=C2C(=C1)C(=CN2)C(C(CNC3=NC=CC(=N3)C4=CC=NC=C4)N)O

Isomeric SMILES

C1=CC=C2C(=C1)C(=CN2)C(C(CNC3=NC=CC(=N3)C4=CC=NC=C4)N)O

InChI

InChI=1S/C20H20N6O/c21-16(19(27)15-11-24-18-4-2-1-3-14(15)18)12-25-20-23-10-7-17(26-20)13-5-8-22-9-6-13/h1-11,16,19,24,27H,12,21H2,(H,23,25,26)