3-(1,3-benzodioxol-5-ylmethylsulfanyl)-6-methyl-2H-1,2,4-triazin-5-one

Systemtic Name: 3-(1,3-benzodioxol-5-ylmethylsulfanyl)-6-methyl-2H-1,2,4-triazin-5-one Openeye Name: 3-(1,3-benzodioxol-5-ylmethylsulfanyl)-6-methyl-2H-1,2,4-triazin-5-one CAS Name: 3-(1,3-benzodioxol-5-ylmethylthio)-6-methyl-2H-1,2,4-triazin-5-one IUPAC Name: 3-(1,3-benzodioxol-5-ylmethylsulfanyl)-6-methyl-2H-1,2,4-triazin-5-one Traditional Name: 6-methyl-3-(piperonylthio)-2H-1,2,4-triazin-5-one Formula: C12H11N3O3S MolecularWeight: 277.29904

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Descriptors Computed from Structure

Canonical SMILES:

CC1=NNC(=NC1=O)SCC2=CC3=C(C=C2)OCO3

Isomeric SMILES

CC1=NNC(=NC1=O)SCC2=CC3=C(C=C2)OCO3

InChI

InChI=1S/C12H11N3O3S/c1-7-11(16)13-12(15-14-7)19-5-8-2-3-9-10(4-8)18-6-17-9/h2-4H,5-6H2,1H3,(H,13,15,16)