3-[2-[(5-methyl-1H-imidazol-4-yl)methylsulfanyl]ethylamino]-6-(4-pyridin-2-ylbutyl)-2H-1,2,4-triazin-5-one

Systemtic Name: 3-[2-[(5-methyl-1H-imidazol-4-yl)methylsulfanyl]ethylamino]-6-(4-pyridin-2-ylbutyl)-2H-1,2,4-triazin-5-one Openeye Name: 3-[2-[(5-methyl-1H-imidazol-4-yl)methylsulfanyl]ethylamino]-6-[4-(2-pyridyl)butyl]-2H-1,2,4-triazin-5-one CAS Name: 3-[2-[(5-methyl-1H-imidazol-4-yl)methylthio]ethylamino]-6-[4-(2-pyridinyl)butyl]-2H-1,2,4-triazin-5-one IUPAC Name: 3-[2-[(5-methyl-1H-imidazol-4-yl)methylsulfanyl]ethylamino]-6-(4-pyridin-2-ylbutyl)-2H-1,2,4-triazin-5-one Traditional Name: 3-[2-[(5-methyl-1H-imidazol-4-yl)methylthio]ethylamino]-6-[4-(2-pyridyl)butyl]-2H-1,2,4-triazin-5-one Formula: C19H25N7OS MolecularWeight: 399.5131

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C(N=CN1)CSCCNC2=NC(=O)C(=NN2)CCCCC3=CC=CC=N3

Isomeric SMILES

CC1=C(N=CN1)CSCCNC2=NC(=O)C(=NN2)CCCCC3=CC=CC=N3

InChI

InChI=1S/C19H25N7OS/c1-14-17(23-13-22-14)12-28-11-10-21-19-24-18(27)16(25-26-19)8-3-2-6-15-7-4-5-9-20-15/h4-5,7,9,13H,2-3,6,8,10-12H2,1H3,(H,22,23)(H2,21,24,26,27)