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

Systemtic Name: N-(1,3-benzodioxol-5-ylmethyl)-2-[1,3-bis(oxidanylidene)isoindol-2-yl]-N-methyl-4-methylsulfanyl-butanamide Openeye Name: N-(1,3-benzodioxol-5-ylmethyl)-2-(1,3-dioxoisoindolin-2-yl)-N-methyl-4-methylsulfanyl-butanamide CAS Name: N-(1,3-benzodioxol-5-ylmethyl)-2-(1,3-dioxo-2-isoindolyl)-N-methyl-4-(methylthio)butanamide IUPAC Name: N-(1,3-benzodioxol-5-ylmethyl)-2-(1,3-dioxoisoindol-2-yl)-N-methyl-4-methylsulfanylbutanamide Traditional Name: N-methyl-4-(methylthio)-2-phthalimido-N-piperonyl-butyramide Formula: C22H22N2O5S MolecularWeight: 426.48548

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Descriptors Computed from Structure

Canonical SMILES:

CN(CC1=CC2=C(C=C1)OCO2)C(=O)C(CCSC)N3C(=O)C4=CC=CC=C4C3=O

Isomeric SMILES

CN(CC1=CC2=C(C=C1)OCO2)C(=O)C(CCSC)N3C(=O)C4=CC=CC=C4C3=O

InChI

InChI=1S/C22H22N2O5S/c1-23(12-14-7-8-18-19(11-14)29-13-28-18)22(27)17(9-10-30-2)24-20(25)15-5-3-4-6-16(15)21(24)26/h3-8,11,17H,9-10,12-13H2,1-2H3