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

Systemtic Name: 6-[(4-methoxyphenyl)methyl]-3-methylsulfanyl-2H-1,2,4-triazin-5-one Openeye Name: 6-[(4-methoxyphenyl)methyl]-3-methylsulfanyl-2H-1,2,4-triazin-5-one CAS Name: 6-[(4-methoxyphenyl)methyl]-3-(methylthio)-2H-1,2,4-triazin-5-one IUPAC Name: 6-[(4-methoxyphenyl)methyl]-3-methylsulfanyl-2H-1,2,4-triazin-5-one Traditional Name: 3-(methylthio)-6-p-anisyl-2H-1,2,4-triazin-5-one Formula: C24H26N6O4S2 MolecularWeight: 526.63104

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Descriptors Computed from Structure

Canonical SMILES:

COC1=CC=C(C=C1)CC2=NNC(=NC2=O)SC.COC1=CC=C(C=C1)CC2=NNC(=NC2=O)SC

Isomeric SMILES

COC1=CC=C(C=C1)CC2=NNC(=NC2=O)SC.COC1=CC=C(C=C1)CC2=NNC(=NC2=O)SC

InChI

InChI=1S/2C12H13N3O2S/c2*1-17-9-5-3-8(4-6-9)7-10-11(16)13-12(18-2)15-14-10/h2*3-6H,7H2,1-2H3,(H,13,15,16)