3-(5-methyl-2-oxidanylidene-hexyl)-2-(7-methylsulfanyl-1,8-naphthyridin-2-yl)-3H-isoindol-1-one

Systemtic Name: 3-(5-methyl-2-oxidanylidene-hexyl)-2-(7-methylsulfanyl-1,8-naphthyridin-2-yl)-3H-isoindol-1-one Openeye Name: 3-(5-methyl-2-oxo-hexyl)-2-(7-methylsulfanyl-1,8-naphthyridin-2-yl)isoindolin-1-one CAS Name: 3-(5-methyl-2-oxohexyl)-2-[7-(methylthio)-1,8-naphthyridin-2-yl]-3H-isoindol-1-one IUPAC Name: 3-(5-methyl-2-oxohexyl)-2-(7-methylsulfanyl-1,8-naphthyridin-2-yl)-3H-isoindol-1-one Traditional Name: 3-(2-keto-5-methyl-hexyl)-2-[7-(methylthio)-1,8-naphthyridin-2-yl]isoindolin-1-one Formula: C24H25N3O2S MolecularWeight: 419.5392

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)CCC(=O)CC1C2=CC=CC=C2C(=O)N1C3=NC4=C(C=C3)C=CC(=N4)SC

Isomeric SMILES

CC(C)CCC(=O)CC1C2=CC=CC=C2C(=O)N1C3=NC4=C(C=C3)C=CC(=N4)SC

InChI

InChI=1S/C24H25N3O2S/c1-15(2)8-11-17(28)14-20-18-6-4-5-7-19(18)24(29)27(20)21-12-9-16-10-13-22(30-3)26-23(16)25-21/h4-7,9-10,12-13,15,20H,8,11,14H2,1-3H3