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9-(10H-pyrazino[2,3-b][1,4]benzothiazin-8-ylmethyl)purine-6-carbothioamide

9-(10H-pyrazino[2,3-b][1,4]benzothiazin-8-ylmethyl)purine-6-carbothioamide

Systemtic Name:9-(10H-pyrazino[2,3-b][1,4]benzothiazin-8-ylmethyl)purine-6-carbothioamide
Openeye Name:9-(10H-pyrazino[2,3-b][1,4]benzothiazin-8-ylmethyl)purine-6-carbothioamide
CAS Name:9-(10H-pyrazino[2,3-b][1,4]benzothiazin-8-ylmethyl)-6-purinecarbothioamide
IUPAC Name:9-(10H-pyrazino[2,3-b][1,4]benzothiazin-8-ylmethyl)purine-6-carbothioamide
Traditional Name:9-(10H-pyrazino[2,3-b][1,4]benzothiazin-8-ylmethyl)purine-6-carbothioamide
Formula: C17H12N8S2
MolecularWeight: 392.46078
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Descriptors Computed from Structure

Canonical SMILES:

C1=CC2=C(C=C1CN3C=NC4=C(N=CN=C43)C(=S)N)NC5=NC=CN=C5S2


Isomeric SMILES

C1=CC2=C(C=C1CN3C=NC4=C(N=CN=C43)C(=S)N)NC5=NC=CN=C5S2


InChI

InChI=1S/C17H12N8S2/c18-14(26)12-13-16(22-7-21-12)25(8-23-13)6-9-1-2-11-10(5-9)24-15-17(27-11)20-4-3-19-15/h1-5,7-8H,6H2,(H2,18,26)(H,19,24)


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