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

Systemtic Name: 3-[2-[(5-methyl-1H-imidazol-4-yl)methylsulfanyl]ethylamino]-6-(2-pyridin-2-ylethyl)-2H-1,2,4-triazin-5-one Openeye Name: 3-[2-[(5-methyl-1H-imidazol-4-yl)methylsulfanyl]ethylamino]-6-[2-(2-pyridyl)ethyl]-2H-1,2,4-triazin-5-one CAS Name: 3-[2-[(5-methyl-1H-imidazol-4-yl)methylthio]ethylamino]-6-[2-(2-pyridinyl)ethyl]-2H-1,2,4-triazin-5-one IUPAC Name: 3-[2-[(5-methyl-1H-imidazol-4-yl)methylsulfanyl]ethylamino]-6-(2-pyridin-2-ylethyl)-2H-1,2,4-triazin-5-one Traditional Name: 3-[2-[(5-methyl-1H-imidazol-4-yl)methylthio]ethylamino]-6-[2-(2-pyridyl)ethyl]-2H-1,2,4-triazin-5-one Formula: C17H21N7OS MolecularWeight: 371.45994

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C(N=CN1)CSCCNC2=NC(=O)C(=NN2)CCC3=CC=CC=N3

Isomeric SMILES

CC1=C(N=CN1)CSCCNC2=NC(=O)C(=NN2)CCC3=CC=CC=N3

InChI

InChI=1S/C17H21N7OS/c1-12-15(21-11-20-12)10-26-9-8-19-17-22-16(25)14(23-24-17)6-5-13-4-2-3-7-18-13/h2-4,7,11H,5-6,8-10H2,1H3,(H,20,21)(H2,19,22,24,25)