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

Systemtic Name: 3-[(2-methylphenyl)methylsulfanyl]-6-(phenylmethyl)-2H-1,2,4-triazin-5-one Openeye Name: 6-benzyl-3-(o-tolylmethylsulfanyl)-2H-1,2,4-triazin-5-one CAS Name: 3-[(2-methylphenyl)methylthio]-6-(phenylmethyl)-2H-1,2,4-triazin-5-one IUPAC Name: 6-benzyl-3-[(2-methylphenyl)methylsulfanyl]-2H-1,2,4-triazin-5-one Traditional Name: 6-benzyl-3-[(2-methylbenzyl)thio]-2H-1,2,4-triazin-5-one Formula: C18H17N3OS MolecularWeight: 323.41208

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC=CC=C1CSC2=NC(=O)C(=NN2)CC3=CC=CC=C3

Isomeric SMILES

CC1=CC=CC=C1CSC2=NC(=O)C(=NN2)CC3=CC=CC=C3

InChI

InChI=1S/C18H17N3OS/c1-13-7-5-6-10-15(13)12-23-18-19-17(22)16(20-21-18)11-14-8-3-2-4-9-14/h2-10H,11-12H2,1H3,(H,19,21,22)