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

Systemtic Name: 6-(pyridin-3-ylmethyl)-3-[2-(pyridin-2-ylmethylsulfanyl)ethylamino]-2H-1,2,4-triazin-5-one Openeye Name: 6-(3-pyridylmethyl)-3-[2-(2-pyridylmethylsulfanyl)ethylamino]-2H-1,2,4-triazin-5-one CAS Name: 6-(3-pyridinylmethyl)-3-[2-(2-pyridinylmethylthio)ethylamino]-2H-1,2,4-triazin-5-one IUPAC Name: 6-(pyridin-3-ylmethyl)-3-[2-(pyridin-2-ylmethylsulfanyl)ethylamino]-2H-1,2,4-triazin-5-one Traditional Name: 6-(3-pyridylmethyl)-3-[2-(2-pyridylmethylthio)ethylamino]-2H-1,2,4-triazin-5-one Formula: C17H18N6OS MolecularWeight: 354.42942

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC=NC(=C1)CSCCNC2=NC(=O)C(=NN2)CC3=CN=CC=C3

Isomeric SMILES

C1=CC=NC(=C1)CSCCNC2=NC(=O)C(=NN2)CC3=CN=CC=C3

InChI

InChI=1S/C17H18N6OS/c24-16-15(10-13-4-3-6-18-11-13)22-23-17(21-16)20-8-9-25-12-14-5-1-2-7-19-14/h1-7,11H,8-10,12H2,(H2,20,21,23,24)