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

Systemtic Name: 6-methyl-3-(2-phenoxyethylsulfanyl)-2H-1,2,4-triazin-5-one Openeye Name: 6-methyl-3-(2-phenoxyethylsulfanyl)-2H-1,2,4-triazin-5-one CAS Name: 6-methyl-3-(2-phenoxyethylthio)-2H-1,2,4-triazin-5-one IUPAC Name: 6-methyl-3-(2-phenoxyethylsulfanyl)-2H-1,2,4-triazin-5-one Traditional Name: 6-methyl-3-(2-phenoxyethylthio)-2H-1,2,4-triazin-5-one Formula: C12H13N3O2S MolecularWeight: 263.31552

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Descriptors Computed from Structure

Canonical SMILES:

CC1=NNC(=NC1=O)SCCOC2=CC=CC=C2

Isomeric SMILES

CC1=NNC(=NC1=O)SCCOC2=CC=CC=C2

InChI

InChI=1S/C12H13N3O2S/c1-9-11(16)13-12(15-14-9)18-8-7-17-10-5-3-2-4-6-10/h2-6H,7-8H2,1H3,(H,13,15,16)