2-[1,3-bis(oxidanylidene)isoindol-2-yl]-N-(2,3-dihydro-1,4-benzodioxin-3-ylmethyl)-4-methylsulfanyl-butanamide

Systemtic Name: 2-[1,3-bis(oxidanylidene)isoindol-2-yl]-N-(2,3-dihydro-1,4-benzodioxin-3-ylmethyl)-4-methylsulfanyl-butanamide Openeye Name: N-(2,3-dihydro-1,4-benzodioxin-3-ylmethyl)-2-(1,3-dioxoisoindolin-2-yl)-4-methylsulfanyl-butanamide CAS Name: N-(2,3-dihydro-1,4-benzodioxin-3-ylmethyl)-2-(1,3-dioxo-2-isoindolyl)-4-(methylthio)butanamide IUPAC Name: N-(2,3-dihydro-1,4-benzodioxin-3-ylmethyl)-2-(1,3-dioxoisoindol-2-yl)-4-methylsulfanylbutanamide Traditional Name: N-(2,3-dihydro-1,4-benzodioxin-3-ylmethyl)-4-(methylthio)-2-phthalimido-butyramide Formula: C22H22N2O5S MolecularWeight: 426.48548

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Descriptors Computed from Structure

Canonical SMILES:

CSCCC(C(=O)NCC1COC2=CC=CC=C2O1)N3C(=O)C4=CC=CC=C4C3=O

Isomeric SMILES

CSCCC(C(=O)NCC1COC2=CC=CC=C2O1)N3C(=O)C4=CC=CC=C4C3=O

InChI

InChI=1S/C22H22N2O5S/c1-30-11-10-17(24-21(26)15-6-2-3-7-16(15)22(24)27)20(25)23-12-14-13-28-18-8-4-5-9-19(18)29-14/h2-9,14,17H,10-13H2,1H3,(H,23,25)