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

Systemtic Name: N-[4-[[1,3-bis(oxidanylidene)isoindol-2-yl]methylsulfanyl]phenyl]-3,3-dimethyl-butanamide Openeye Name: N-[4-[(1,3-dioxoisoindolin-2-yl)methylsulfanyl]phenyl]-3,3-dimethyl-butanamide CAS Name: N-[4-[(1,3-dioxo-2-isoindolyl)methylthio]phenyl]-3,3-dimethylbutanamide IUPAC Name: N-[4-[(1,3-dioxoisoindol-2-yl)methylsulfanyl]phenyl]-3,3-dimethylbutanamide Traditional Name: 3,3-dimethyl-N-[4-(phthalimidomethylthio)phenyl]butyramide Formula: C21H22N2O3S MolecularWeight: 382.47598

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CC(C)(C)CC(=O)NC1=CC=C(C=C1)SCN2C(=O)C3=CC=CC=C3C2=O

Isomeric SMILES

CC(C)(C)CC(=O)NC1=CC=C(C=C1)SCN2C(=O)C3=CC=CC=C3C2=O

InChI

InChI=1S/C21H22N2O3S/c1-21(2,3)12-18(24)22-14-8-10-15(11-9-14)27-13-23-19(25)16-6-4-5-7-17(16)20(23)26/h4-11H,12-13H2,1-3H3,(H,22,24)