2-[(5,6-dipyridin-2-yl-1,2,4-triazin-3-yl)sulfanyl]-1-(5-methyl-2-oxidanyl-phenyl)ethanone

Systemtic Name: 2-[(5,6-dipyridin-2-yl-1,2,4-triazin-3-yl)sulfanyl]-1-(5-methyl-2-oxidanyl-phenyl)ethanone Openeye Name: 2-[[5,6-bis(2-pyridyl)-1,2,4-triazin-3-yl]sulfanyl]-1-(2-hydroxy-5-methyl-phenyl)ethanone CAS Name: 2-[[5,6-bis(2-pyridinyl)-1,2,4-triazin-3-yl]thio]-1-(2-hydroxy-5-methylphenyl)ethanone IUPAC Name: 2-[(5,6-dipyridin-2-yl-1,2,4-triazin-3-yl)sulfanyl]-1-(2-hydroxy-5-methylphenyl)ethanone Traditional Name: 2-[[5,6-bis(2-pyridyl)-1,2,4-triazin-3-yl]thio]-1-(2-hydroxy-5-methyl-phenyl)ethanone Formula: C22H17N5O2S MolecularWeight: 415.46768

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC(=C(C=C1)O)C(=O)CSC2=NC(=C(N=N2)C3=CC=CC=N3)C4=CC=CC=N4

Isomeric SMILES

CC1=CC(=C(C=C1)O)C(=O)CSC2=NC(=C(N=N2)C3=CC=CC=N3)C4=CC=CC=N4

InChI

InChI=1S/C22H17N5O2S/c1-14-8-9-18(28)15(12-14)19(29)13-30-22-25-20(16-6-2-4-10-23-16)21(26-27-22)17-7-3-5-11-24-17/h2-12,28H,13H2,1H3