2-decylsulfanyl-5-methyl-1H-[1,2,4]triazolo[1,5-a]pyrimidin-7-one

Systemtic Name: 2-decylsulfanyl-5-methyl-1H-[1,2,4]triazolo[1,5-a]pyrimidin-7-one Openeye Name: 2-decylsulfanyl-5-methyl-1H-[1,2,4]triazolo[1,5-a]pyrimidin-7-one CAS Name: 2-(decylthio)-5-methyl-1H-[1,2,4]triazolo[1,5-a]pyrimidin-7-one IUPAC Name: 2-decylsulfanyl-5-methyl-1H-[1,2,4]triazolo[1,5-a]pyrimidin-7-one Traditional Name: 2-(decylthio)-5-methyl-1H-[1,2,4]triazolo[1,5-a]pyrimidin-7-one Formula: C16H26N4OS MolecularWeight: 322.46884

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Descriptors Computed from Structure

Canonical SMILES:

CCCCCCCCCCSC1=NC2=NC(=CC(=O)N2N1)C

Isomeric SMILES

CCCCCCCCCCSC1=NC2=NC(=CC(=O)N2N1)C

InChI

InChI=1S/C16H26N4OS/c1-3-4-5-6-7-8-9-10-11-22-16-18-15-17-13(2)12-14(21)20(15)19-16/h12H,3-11H2,1-2H3,(H,17,18,19)