6-methyl-3-[[4-(phenylcarbonyl)phenyl]methylsulfanyl]-2H-1,2,4-triazin-5-one

Systemtic Name: 6-methyl-3-[[4-(phenylcarbonyl)phenyl]methylsulfanyl]-2H-1,2,4-triazin-5-one Openeye Name: 3-[(4-benzoylphenyl)methylsulfanyl]-6-methyl-2H-1,2,4-triazin-5-one CAS Name: 3-[(4-benzoylphenyl)methylthio]-6-methyl-2H-1,2,4-triazin-5-one IUPAC Name: 3-[(4-benzoylphenyl)methylsulfanyl]-6-methyl-2H-1,2,4-triazin-5-one Traditional Name: 3-[(4-benzoylbenzyl)thio]-6-methyl-2H-1,2,4-triazin-5-one Formula: C18H15N3O2S MolecularWeight: 337.3956

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Descriptors Computed from Structure

Canonical SMILES:

CC1=NNC(=NC1=O)SCC2=CC=C(C=C2)C(=O)C3=CC=CC=C3

Isomeric SMILES

CC1=NNC(=NC1=O)SCC2=CC=C(C=C2)C(=O)C3=CC=CC=C3

InChI

InChI=1S/C18H15N3O2S/c1-12-17(23)19-18(21-20-12)24-11-13-7-9-15(10-8-13)16(22)14-5-3-2-4-6-14/h2-10H,11H2,1H3,(H,19,21,23)