2-[5-phenyl-7-(pyridin-3-ylmethylamino)pyrazolo[1,5-a]pyrimidin-3-yl]sulfanylethanol

Systemtic Name: 2-[5-phenyl-7-(pyridin-3-ylmethylamino)pyrazolo[1,5-a]pyrimidin-3-yl]sulfanylethanol Openeye Name: 2-[5-phenyl-7-(3-pyridylmethylamino)pyrazolo[1,5-a]pyrimidin-3-yl]sulfanylethanol CAS Name: 2-[[5-phenyl-7-(3-pyridinylmethylamino)-3-pyrazolo[1,5-a]pyrimidinyl]thio]ethanol IUPAC Name: 2-[5-phenyl-7-(pyridin-3-ylmethylamino)pyrazolo[1,5-a]pyrimidin-3-yl]sulfanylethanol Traditional Name: 2-[[5-phenyl-7-(3-pyridylmethylamino)pyrazolo[1,5-a]pyrimidin-3-yl]thio]ethanol Formula: C20H19N5OS MolecularWeight: 377.46276

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC=C(C=C1)C2=NC3=C(C=NN3C(=C2)NCC4=CN=CC=C4)SCCO

Isomeric SMILES

C1=CC=C(C=C1)C2=NC3=C(C=NN3C(=C2)NCC4=CN=CC=C4)SCCO

InChI

InChI=1S/C20H19N5OS/c26-9-10-27-18-14-23-25-19(22-13-15-5-4-8-21-12-15)11-17(24-20(18)25)16-6-2-1-3-7-16/h1-8,11-12,14,22,26H,9-10,13H2