2-[7-(10H-pyrazino[2,3-b][1,4]benzothiazin-8-ylmethyl)purin-6-yl]propan-2-ol

Systemtic Name: 2-[7-(10H-pyrazino[2,3-b][1,4]benzothiazin-8-ylmethyl)purin-6-yl]propan-2-ol Openeye Name: 2-[7-(10H-pyrazino[2,3-b][1,4]benzothiazin-8-ylmethyl)purin-6-yl]propan-2-ol CAS Name: 2-[7-(10H-pyrazino[2,3-b][1,4]benzothiazin-8-ylmethyl)-6-purinyl]-2-propanol IUPAC Name: 2-[7-(10H-pyrazino[2,3-b][1,4]benzothiazin-8-ylmethyl)purin-6-yl]propan-2-ol Traditional Name: 2-[7-(10H-pyrazino[2,3-b][1,4]benzothiazin-8-ylmethyl)purin-6-yl]propan-2-ol Formula: C19H17N7OS MolecularWeight: 391.44958

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)(C1=C2C(=NC=N1)N=CN2CC3=CC4=C(C=C3)SC5=NC=CN=C5N4)O

Isomeric SMILES

CC(C)(C1=C2C(=NC=N1)N=CN2CC3=CC4=C(C=C3)SC5=NC=CN=C5N4)O

InChI

InChI=1S/C19H17N7OS/c1-19(2,27)15-14-16(23-9-22-15)24-10-26(14)8-11-3-4-13-12(7-11)25-17-18(28-13)21-6-5-20-17/h3-7,9-10,27H,8H2,1-2H3,(H,20,25)