6-[(2-methylphenyl)methyl]-3-[2-(4-methylphenyl)-2-oxidanylidene-ethyl]sulfanyl-2H-1,2,4-triazin-5-one

Systemtic Name: 6-[(2-methylphenyl)methyl]-3-[2-(4-methylphenyl)-2-oxidanylidene-ethyl]sulfanyl-2H-1,2,4-triazin-5-one Openeye Name: 6-(o-tolylmethyl)-3-[2-oxo-2-(p-tolyl)ethyl]sulfanyl-2H-1,2,4-triazin-5-one CAS Name: 6-[(2-methylphenyl)methyl]-3-[[2-(4-methylphenyl)-2-oxoethyl]thio]-2H-1,2,4-triazin-5-one IUPAC Name: 6-[(2-methylphenyl)methyl]-3-[2-(4-methylphenyl)-2-oxoethyl]sulfanyl-2H-1,2,4-triazin-5-one Traditional Name: 3-[[2-keto-2-(p-tolyl)ethyl]thio]-6-(2-methylbenzyl)-2H-1,2,4-triazin-5-one Formula: C20H19N3O2S MolecularWeight: 365.44876

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC=C(C=C1)C(=O)CSC2=NC(=O)C(=NN2)CC3=CC=CC=C3C

Isomeric SMILES

CC1=CC=C(C=C1)C(=O)CSC2=NC(=O)C(=NN2)CC3=CC=CC=C3C

InChI

InChI=1S/C20H19N3O2S/c1-13-7-9-15(10-8-13)18(24)12-26-20-21-19(25)17(22-23-20)11-16-6-4-3-5-14(16)2/h3-10H,11-12H2,1-2H3,(H,21,23,25)