1-(1,2-dihydroacenaphthylen-5-yl)-2-[(4-methyl-5-pyridin-3-yl-1,2,4-triazol-3-yl)sulfanyl]ethanone

Systemtic Name: 1-(1,2-dihydroacenaphthylen-5-yl)-2-[(4-methyl-5-pyridin-3-yl-1,2,4-triazol-3-yl)sulfanyl]ethanone Openeye Name: 1-(1,2-dihydroacenaphthylen-5-yl)-2-[[4-methyl-5-(3-pyridyl)-1,2,4-triazol-3-yl]sulfanyl]ethanone CAS Name: 1-(1,2-dihydroacenaphthylen-5-yl)-2-[[4-methyl-5-(3-pyridinyl)-1,2,4-triazol-3-yl]thio]ethanone IUPAC Name: 1-(1,2-dihydroacenaphthylen-5-yl)-2-[(4-methyl-5-pyridin-3-yl-1,2,4-triazol-3-yl)sulfanyl]ethanone Traditional Name: 1-acenaphthen-5-yl-2-[[4-methyl-5-(3-pyridyl)-1,2,4-triazol-3-yl]thio]ethanone Formula: C22H18N4OS MolecularWeight: 386.46952

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Descriptors Computed from Structure

Canonical SMILES:

CN1C(=NN=C1SCC(=O)C2=C3C=CC=C4C3=C(CC4)C=C2)C5=CN=CC=C5

Isomeric SMILES

CN1C(=NN=C1SCC(=O)C2=C3C=CC=C4C3=C(CC4)C=C2)C5=CN=CC=C5

InChI

InChI=1S/C22H18N4OS/c1-26-21(16-5-3-11-23-12-16)24-25-22(26)28-13-19(27)17-10-9-15-8-7-14-4-2-6-18(17)20(14)15/h2-6,9-12H,7-8,13H2,1H3