3-[1,3-bis(oxidanylidene)isoindol-2-yl]-N-(4-butylsulfanylphenyl)propanamide

Systemtic Name: 3-[1,3-bis(oxidanylidene)isoindol-2-yl]-N-(4-butylsulfanylphenyl)propanamide Openeye Name: N-(4-butylsulfanylphenyl)-3-(1,3-dioxoisoindolin-2-yl)propanamide CAS Name: N-[4-(butylthio)phenyl]-3-(1,3-dioxo-2-isoindolyl)propanamide IUPAC Name: N-(4-butylsulfanylphenyl)-3-(1,3-dioxoisoindol-2-yl)propanamide Traditional Name: N-[4-(butylthio)phenyl]-3-phthalimido-propionamide Formula: C21H22N2O3S MolecularWeight: 382.47598

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CCCCSC1=CC=C(C=C1)NC(=O)CCN2C(=O)C3=CC=CC=C3C2=O

Isomeric SMILES

CCCCSC1=CC=C(C=C1)NC(=O)CCN2C(=O)C3=CC=CC=C3C2=O

InChI

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