N-[1,3-bis(oxidanylidene)isoindol-5-yl]-3-(4-methylphenyl)sulfanyl-propanamide

Systemtic Name: N-[1,3-bis(oxidanylidene)isoindol-5-yl]-3-(4-methylphenyl)sulfanyl-propanamide Openeye Name: N-(1,3-dioxoisoindolin-5-yl)-3-(p-tolylsulfanyl)propanamide CAS Name: N-(1,3-dioxo-5-isoindolyl)-3-[(4-methylphenyl)thio]propanamide IUPAC Name: N-(1,3-dioxoisoindol-5-yl)-3-(4-methylphenyl)sulfanylpropanamide Traditional Name: N-(1,3-diketoisoindolin-5-yl)-3-(p-tolylthio)propionamide Formula: C18H16N2O3S MolecularWeight: 340.39624

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CC1=CC=C(C=C1)SCCC(=O)NC2=CC3=C(C=C2)C(=O)NC3=O

Isomeric SMILES

CC1=CC=C(C=C1)SCCC(=O)NC2=CC3=C(C=C2)C(=O)NC3=O

InChI

InChI=1S/C18H16N2O3S/c1-11-2-5-13(6-3-11)24-9-8-16(21)19-12-4-7-14-15(10-12)18(23)20-17(14)22/h2-7,10H,8-9H2,1H3,(H,19,21)(H,20,22,23)