N-(1,3-benzodioxol-5-yl)-2-[1,3-bis(oxidanylidene)isoindol-2-yl]-4-methylsulfanyl-butanamide

Systemtic Name: N-(1,3-benzodioxol-5-yl)-2-[1,3-bis(oxidanylidene)isoindol-2-yl]-4-methylsulfanyl-butanamide Openeye Name: N-(1,3-benzodioxol-5-yl)-2-(1,3-dioxoisoindolin-2-yl)-4-methylsulfanyl-butanamide CAS Name: N-(1,3-benzodioxol-5-yl)-2-(1,3-dioxo-2-isoindolyl)-4-(methylthio)butanamide IUPAC Name: N-(1,3-benzodioxol-5-yl)-2-(1,3-dioxoisoindol-2-yl)-4-methylsulfanylbutanamide Traditional Name: N-(1,3-benzodioxol-5-yl)-4-(methylthio)-2-phthalimido-butyramide Formula: C20H18N2O5S MolecularWeight: 398.43232

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Descriptors Computed from Structure

Canonical SMILES:

CSCCC(C(=O)NC1=CC2=C(C=C1)OCO2)N3C(=O)C4=CC=CC=C4C3=O

Isomeric SMILES

CSCCC(C(=O)NC1=CC2=C(C=C1)OCO2)N3C(=O)C4=CC=CC=C4C3=O

InChI

InChI=1S/C20H18N2O5S/c1-28-9-8-15(22-19(24)13-4-2-3-5-14(13)20(22)25)18(23)21-12-6-7-16-17(10-12)27-11-26-16/h2-7,10,15H,8-9,11H2,1H3,(H,21,23)