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

Systemtic Name: 3-[(4-aminophenyl)methylsulfanyl]-6-(4-methylphenyl)-2H-1,2,4-triazin-5-one Openeye Name: 3-[(4-aminophenyl)methylsulfanyl]-6-(p-tolyl)-2H-1,2,4-triazin-5-one CAS Name: 3-[(4-aminophenyl)methylthio]-6-(4-methylphenyl)-2H-1,2,4-triazin-5-one IUPAC Name: 3-[(4-aminophenyl)methylsulfanyl]-6-(4-methylphenyl)-2H-1,2,4-triazin-5-one Traditional Name: 3-[(4-aminobenzyl)thio]-6-(p-tolyl)-2H-1,2,4-triazin-5-one Formula: C17H16N4OS MolecularWeight: 324.40014

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC=C(C=C1)C2=NNC(=NC2=O)SCC3=CC=C(C=C3)N

Isomeric SMILES

CC1=CC=C(C=C1)C2=NNC(=NC2=O)SCC3=CC=C(C=C3)N

InChI

InChI=1S/C17H16N4OS/c1-11-2-6-13(7-3-11)15-16(22)19-17(21-20-15)23-10-12-4-8-14(18)9-5-12/h2-9H,10,18H2,1H3,(H,19,21,22)