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5-methyl-2-(phenylmethylsulfanyl)-[1,2,4]triazolo[1,5-a]pyrimidin-7-olate

5-methyl-2-(phenylmethylsulfanyl)-[1,2,4]triazolo[1,5-a]pyrimidin-7-olate

Systemtic Name:5-methyl-2-(phenylmethylsulfanyl)-[1,2,4]triazolo[1,5-a]pyrimidin-7-olate
Openeye Name:2-benzylsulfanyl-5-methyl-[1,2,4]triazolo[1,5-a]pyrimidin-7-olate
CAS Name:5-methyl-2-(phenylmethylthio)-[1,2,4]triazolo[1,5-a]pyrimidin-7-olate
IUPAC Name:2-benzylsulfanyl-5-methyl-[1,2,4]triazolo[1,5-a]pyrimidin-7-olate
Traditional Name:2-(benzylthio)-5-methyl-[1,2,4]triazolo[1,5-a]pyrimidin-7-olate
Formula: C13H11N4OS-
MolecularWeight: 271.31764
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Descriptors Computed from Structure

Canonical SMILES:

CC1=NC2=NC(=NN2C(=C1)[O-])SCC3=CC=CC=C3


Isomeric SMILES

CC1=NC2=NC(=NN2C(=C1)[O-])SCC3=CC=CC=C3


InChI

InChI=1S/C13H12N4OS/c1-9-7-11(18)17-12(14-9)15-13(16-17)19-8-10-5-3-2-4-6-10/h2-7,18H,8H2,1H3/p-1


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