2-ethylsulfanyl-5-(pyrimidin-2-ylsulfanylmethyl)-1H-[1,2,4]triazolo[1,5-a]pyrimidin-7-one

Systemtic Name: 2-ethylsulfanyl-5-(pyrimidin-2-ylsulfanylmethyl)-1H-[1,2,4]triazolo[1,5-a]pyrimidin-7-one Openeye Name: 2-ethylsulfanyl-5-(pyrimidin-2-ylsulfanylmethyl)-1H-[1,2,4]triazolo[1,5-a]pyrimidin-7-one CAS Name: 2-(ethylthio)-5-[(2-pyrimidinylthio)methyl]-1H-[1,2,4]triazolo[1,5-a]pyrimidin-7-one IUPAC Name: 2-ethylsulfanyl-5-(pyrimidin-2-ylsulfanylmethyl)-1H-[1,2,4]triazolo[1,5-a]pyrimidin-7-one Traditional Name: 2-(ethylthio)-5-[(2-pyrimidylthio)methyl]-1H-[1,2,4]triazolo[1,5-a]pyrimidin-7-one Formula: C12H12N6OS2 MolecularWeight: 320.39328

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Descriptors Computed from Structure

Canonical SMILES:

CCSC1=NC2=NC(=CC(=O)N2N1)CSC3=NC=CC=N3

Isomeric SMILES

CCSC1=NC2=NC(=CC(=O)N2N1)CSC3=NC=CC=N3

InChI

InChI=1S/C12H12N6OS2/c1-2-20-12-16-10-15-8(6-9(19)18(10)17-12)7-21-11-13-4-3-5-14-11/h3-6H,2,7H2,1H3,(H,15,16,17)