6-methyl-3-phenacylsulfanyl-2H-1,2,4-triazin-5-one

Systemtic Name: 6-methyl-3-phenacylsulfanyl-2H-1,2,4-triazin-5-one Openeye Name: 6-methyl-3-phenacylsulfanyl-2H-1,2,4-triazin-5-one CAS Name: 6-methyl-3-(phenacylthio)-2H-1,2,4-triazin-5-one IUPAC Name: 6-methyl-3-phenacylsulfanyl-2H-1,2,4-triazin-5-one Traditional Name: 6-methyl-3-(phenacylthio)-2H-1,2,4-triazin-5-one Formula: C12H11N3O2S MolecularWeight: 261.29964

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Descriptors Computed from Structure

Canonical SMILES:

CC1=NNC(=NC1=O)SCC(=O)C2=CC=CC=C2

Isomeric SMILES

CC1=NNC(=NC1=O)SCC(=O)C2=CC=CC=C2

InChI

InChI=1S/C12H11N3O2S/c1-8-11(17)13-12(15-14-8)18-7-10(16)9-5-3-2-4-6-9/h2-6H,7H2,1H3,(H,13,15,17)