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

Systemtic Name: 3-[[4-(phenylcarbonyl)phenyl]methylsulfanyl]-6-(phenylmethyl)-2H-1,2,4-triazin-5-one Openeye Name: 3-[(4-benzoylphenyl)methylsulfanyl]-6-benzyl-2H-1,2,4-triazin-5-one CAS Name: 3-[(4-benzoylphenyl)methylthio]-6-(phenylmethyl)-2H-1,2,4-triazin-5-one IUPAC Name: 3-[(4-benzoylphenyl)methylsulfanyl]-6-benzyl-2H-1,2,4-triazin-5-one Traditional Name: 3-[(4-benzoylbenzyl)thio]-6-benzyl-2H-1,2,4-triazin-5-one Formula: C24H19N3O2S MolecularWeight: 413.49156

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC=C(C=C1)CC2=NNC(=NC2=O)SCC3=CC=C(C=C3)C(=O)C4=CC=CC=C4

Isomeric SMILES

C1=CC=C(C=C1)CC2=NNC(=NC2=O)SCC3=CC=C(C=C3)C(=O)C4=CC=CC=C4

InChI

InChI=1S/C24H19N3O2S/c28-22(19-9-5-2-6-10-19)20-13-11-18(12-14-20)16-30-24-25-23(29)21(26-27-24)15-17-7-3-1-4-8-17/h1-14H,15-16H2,(H,25,27,29)