3-[2-[3-[[2-(pyridin-2-ylmethylamino)pyrimidin-4-yl]amino]-1H-pyrazol-5-yl]ethyl]phenol

Systemtic Name: 3-[2-[3-[[2-(pyridin-2-ylmethylamino)pyrimidin-4-yl]amino]-1H-pyrazol-5-yl]ethyl]phenol Openeye Name: 3-[2-[3-[[2-(2-pyridylmethylamino)pyrimidin-4-yl]amino]-1H-pyrazol-5-yl]ethyl]phenol CAS Name: 3-[2-[3-[[2-(2-pyridinylmethylamino)-4-pyrimidinyl]amino]-1H-pyrazol-5-yl]ethyl]phenol IUPAC Name: 3-[2-[3-[[2-(pyridin-2-ylmethylamino)pyrimidin-4-yl]amino]-1H-pyrazol-5-yl]ethyl]phenol Traditional Name: 3-[2-[3-[[2-(2-pyridylmethylamino)pyrimidin-4-yl]amino]-1H-pyrazol-5-yl]ethyl]phenol Formula: C21H21N7O MolecularWeight: 387.43774

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC=NC(=C1)CNC2=NC=CC(=N2)NC3=NNC(=C3)CCC4=CC(=CC=C4)O

Isomeric SMILES

C1=CC=NC(=C1)CNC2=NC=CC(=N2)NC3=NNC(=C3)CCC4=CC(=CC=C4)O

InChI

InChI=1S/C21H21N7O/c29-18-6-3-4-15(12-18)7-8-16-13-20(28-27-16)25-19-9-11-23-21(26-19)24-14-17-5-1-2-10-22-17/h1-6,9-13,29H,7-8,14H2,(H3,23,24,25,26,27,28)