5-(2,6-dimethoxyphenyl)-N-[(3-methylsulfanylphenyl)methyl]-1,2,4-triazin-3-amine

Systemtic Name: 5-(2,6-dimethoxyphenyl)-N-[(3-methylsulfanylphenyl)methyl]-1,2,4-triazin-3-amine Openeye Name: 5-(2,6-dimethoxyphenyl)-N-[(3-methylsulfanylphenyl)methyl]-1,2,4-triazin-3-amine CAS Name: 5-(2,6-dimethoxyphenyl)-N-[[3-(methylthio)phenyl]methyl]-1,2,4-triazin-3-amine IUPAC Name: 5-(2,6-dimethoxyphenyl)-N-[(3-methylsulfanylphenyl)methyl]-1,2,4-triazin-3-amine Traditional Name: [5-(2,6-dimethoxyphenyl)-1,2,4-triazin-3-yl]-[3-(methylthio)benzyl]amine Formula: C19H20N4O2S MolecularWeight: 368.4527

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Descriptors Computed from Structure

Canonical SMILES:

COC1=C(C(=CC=C1)OC)C2=CN=NC(=N2)NCC3=CC(=CC=C3)SC

Isomeric SMILES

COC1=C(C(=CC=C1)OC)C2=CN=NC(=N2)NCC3=CC(=CC=C3)SC

InChI

InChI=1S/C19H20N4O2S/c1-24-16-8-5-9-17(25-2)18(16)15-12-21-23-19(22-15)20-11-13-6-4-7-14(10-13)26-3/h4-10,12H,11H2,1-3H3,(H,20,22,23)