4-[[2-[1,3-bis(oxidanylidene)isoindol-2-yl]-4-methylsulfanyl-butanoyl]amino]benzamide

Systemtic Name: 4-[[2-[1,3-bis(oxidanylidene)isoindol-2-yl]-4-methylsulfanyl-butanoyl]amino]benzamide Openeye Name: 4-[[2-(1,3-dioxoisoindolin-2-yl)-4-methylsulfanyl-butanoyl]amino]benzamide CAS Name: 4-[[2-(1,3-dioxo-2-isoindolyl)-4-(methylthio)-1-oxobutyl]amino]benzamide IUPAC Name: 4-[[2-(1,3-dioxoisoindol-2-yl)-4-methylsulfanylbutanoyl]amino]benzamide Traditional Name: 4-[[4-(methylthio)-2-phthalimido-butanoyl]amino]benzamide Formula: C20H19N3O4S MolecularWeight: 397.44756

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Descriptors Computed from Structure

Canonical SMILES:

CSCCC(C(=O)NC1=CC=C(C=C1)C(=O)N)N2C(=O)C3=CC=CC=C3C2=O

Isomeric SMILES

CSCCC(C(=O)NC1=CC=C(C=C1)C(=O)N)N2C(=O)C3=CC=CC=C3C2=O

InChI

InChI=1S/C20H19N3O4S/c1-28-11-10-16(18(25)22-13-8-6-12(7-9-13)17(21)24)23-19(26)14-4-2-3-5-15(14)20(23)27/h2-9,16H,10-11H2,1H3,(H2,21,24)(H,22,25)