6-(4-methylphenyl)-3-(3-phenoxypropylsulfanyl)-2H-1,2,4-triazin-5-one

Systemtic Name: 6-(4-methylphenyl)-3-(3-phenoxypropylsulfanyl)-2H-1,2,4-triazin-5-one Openeye Name: 3-(3-phenoxypropylsulfanyl)-6-(p-tolyl)-2H-1,2,4-triazin-5-one CAS Name: 6-(4-methylphenyl)-3-(3-phenoxypropylthio)-2H-1,2,4-triazin-5-one IUPAC Name: 6-(4-methylphenyl)-3-(3-phenoxypropylsulfanyl)-2H-1,2,4-triazin-5-one Traditional Name: 3-(3-phenoxypropylthio)-6-(p-tolyl)-2H-1,2,4-triazin-5-one Formula: C19H19N3O2S MolecularWeight: 353.43806

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC=C(C=C1)C2=NNC(=NC2=O)SCCCOC3=CC=CC=C3

Isomeric SMILES

CC1=CC=C(C=C1)C2=NNC(=NC2=O)SCCCOC3=CC=CC=C3

InChI

InChI=1S/C19H19N3O2S/c1-14-8-10-15(11-9-14)17-18(23)20-19(22-21-17)25-13-5-12-24-16-6-3-2-4-7-16/h2-4,6-11H,5,12-13H2,1H3,(H,20,22,23)