6-(pyridin-3-ylmethyl)-3-[2-(1,2-thiazol-3-ylmethylsulfanyl)ethylamino]-2H-1,2,4-triazin-5-one

Systemtic Name: 6-(pyridin-3-ylmethyl)-3-[2-(1,2-thiazol-3-ylmethylsulfanyl)ethylamino]-2H-1,2,4-triazin-5-one Openeye Name: 3-[2-(isothiazol-3-ylmethylsulfanyl)ethylamino]-6-(3-pyridylmethyl)-2H-1,2,4-triazin-5-one CAS Name: 3-[2-(3-isothiazolylmethylthio)ethylamino]-6-(3-pyridinylmethyl)-2H-1,2,4-triazin-5-one IUPAC Name: 6-(pyridin-3-ylmethyl)-3-[2-(1,2-thiazol-3-ylmethylsulfanyl)ethylamino]-2H-1,2,4-triazin-5-one Traditional Name: 3-[2-(isothiazol-3-ylmethylthio)ethylamino]-6-(3-pyridylmethyl)-2H-1,2,4-triazin-5-one Formula: C15H16N6OS2 MolecularWeight: 360.45714

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC(=CN=C1)CC2=NNC(=NC2=O)NCCSCC3=NSC=C3

Isomeric SMILES

C1=CC(=CN=C1)CC2=NNC(=NC2=O)NCCSCC3=NSC=C3

InChI

InChI=1S/C15H16N6OS2/c22-14-13(8-11-2-1-4-16-9-11)19-20-15(18-14)17-5-7-23-10-12-3-6-24-21-12/h1-4,6,9H,5,7-8,10H2,(H2,17,18,20,22)