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

Systemtic Name: 3-[2-[(3-methylpyridin-2-yl)methylsulfanyl]ethylamino]-6-(pyridin-3-ylmethyl)-2H-1,2,4-triazin-5-one Openeye Name: 3-[2-[(3-methyl-2-pyridyl)methylsulfanyl]ethylamino]-6-(3-pyridylmethyl)-2H-1,2,4-triazin-5-one CAS Name: 3-[2-[(3-methyl-2-pyridinyl)methylthio]ethylamino]-6-(3-pyridinylmethyl)-2H-1,2,4-triazin-5-one IUPAC Name: 3-[2-[(3-methylpyridin-2-yl)methylsulfanyl]ethylamino]-6-(pyridin-3-ylmethyl)-2H-1,2,4-triazin-5-one Traditional Name: 3-[2-[(3-methyl-2-pyridyl)methylthio]ethylamino]-6-(3-pyridylmethyl)-2H-1,2,4-triazin-5-one Formula: C18H20N6OS MolecularWeight: 368.456

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C(N=CC=C1)CSCCNC2=NC(=O)C(=NN2)CC3=CN=CC=C3

Isomeric SMILES

CC1=C(N=CC=C1)CSCCNC2=NC(=O)C(=NN2)CC3=CN=CC=C3

InChI

InChI=1S/C18H20N6OS/c1-13-4-2-7-20-16(13)12-26-9-8-21-18-22-17(25)15(23-24-18)10-14-5-3-6-19-11-14/h2-7,11H,8-10,12H2,1H3,(H2,21,22,24,25)