5-(1,3-benzodioxol-5-yl)-N-[2-(1-methylimidazol-2-yl)sulfanylethyl]-1,2,4-triazin-3-amine

Systemtic Name: 5-(1,3-benzodioxol-5-yl)-N-[2-(1-methylimidazol-2-yl)sulfanylethyl]-1,2,4-triazin-3-amine Openeye Name: 5-(1,3-benzodioxol-5-yl)-N-[2-(1-methylimidazol-2-yl)sulfanylethyl]-1,2,4-triazin-3-amine CAS Name: 5-(1,3-benzodioxol-5-yl)-N-[2-[(1-methyl-2-imidazolyl)thio]ethyl]-1,2,4-triazin-3-amine IUPAC Name: 5-(1,3-benzodioxol-5-yl)-N-[2-(1-methylimidazol-2-yl)sulfanylethyl]-1,2,4-triazin-3-amine Traditional Name: [5-(1,3-benzodioxol-5-yl)-1,2,4-triazin-3-yl]-[2-[(1-methylimidazol-2-yl)thio]ethyl]amine Formula: C16H16N6O2S MolecularWeight: 356.40224

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Descriptors Computed from Structure

Canonical SMILES:

CN1C=CN=C1SCCNC2=NC(=CN=N2)C3=CC4=C(C=C3)OCO4

Isomeric SMILES

CN1C=CN=C1SCCNC2=NC(=CN=N2)C3=CC4=C(C=C3)OCO4

InChI

InChI=1S/C16H16N6O2S/c1-22-6-4-18-16(22)25-7-5-17-15-20-12(9-19-21-15)11-2-3-13-14(8-11)24-10-23-13/h2-4,6,8-9H,5,7,10H2,1H3,(H,17,20,21)