4-[5-methyl-1,3-bis(oxidanylidene)isoindol-2-yl]-N-(2-prop-2-enylsulfanylphenyl)butanamide

Systemtic Name: 4-[5-methyl-1,3-bis(oxidanylidene)isoindol-2-yl]-N-(2-prop-2-enylsulfanylphenyl)butanamide Openeye Name: N-(2-allylsulfanylphenyl)-4-(5-methyl-1,3-dioxo-isoindolin-2-yl)butanamide CAS Name: 4-(5-methyl-1,3-dioxo-2-isoindolyl)-N-[2-(prop-2-enylthio)phenyl]butanamide IUPAC Name: 4-(5-methyl-1,3-dioxoisoindol-2-yl)-N-(2-prop-2-enylsulfanylphenyl)butanamide Traditional Name: N-[2-(allylthio)phenyl]-4-(1,3-diketo-5-methyl-isoindolin-2-yl)butyramide Formula: C22H22N2O3S MolecularWeight: 394.48668

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC2=C(C=C1)C(=O)N(C2=O)CCCC(=O)NC3=CC=CC=C3SCC=C

Isomeric SMILES

CC1=CC2=C(C=C1)C(=O)N(C2=O)CCCC(=O)NC3=CC=CC=C3SCC=C

InChI

InChI=1S/C22H22N2O3S/c1-3-13-28-19-8-5-4-7-18(19)23-20(25)9-6-12-24-21(26)16-11-10-15(2)14-17(16)22(24)27/h3-5,7-8,10-11,14H,1,6,9,12-13H2,2H3,(H,23,25)