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

Systemtic Name: 4-[1,3-bis(oxidanylidene)isoindol-2-yl]-N-[2-methyl-4-(phenylsulfanylmethyl)phenyl]butanamide Openeye Name: 4-(1,3-dioxoisoindolin-2-yl)-N-[2-methyl-4-(phenylsulfanylmethyl)phenyl]butanamide CAS Name: 4-(1,3-dioxo-2-isoindolyl)-N-[2-methyl-4-[(phenylthio)methyl]phenyl]butanamide IUPAC Name: 4-(1,3-dioxoisoindol-2-yl)-N-[2-methyl-4-(phenylsulfanylmethyl)phenyl]butanamide Traditional Name: N-[2-methyl-4-[(phenylthio)methyl]phenyl]-4-phthalimido-butyramide Formula: C26H24N2O3S MolecularWeight: 444.54536

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CC1=C(C=CC(=C1)CSC2=CC=CC=C2)NC(=O)CCCN3C(=O)C4=CC=CC=C4C3=O

Isomeric SMILES

CC1=C(C=CC(=C1)CSC2=CC=CC=C2)NC(=O)CCCN3C(=O)C4=CC=CC=C4C3=O

InChI

InChI=1S/C26H24N2O3S/c1-18-16-19(17-32-20-8-3-2-4-9-20)13-14-23(18)27-24(29)12-7-15-28-25(30)21-10-5-6-11-22(21)26(28)31/h2-6,8-11,13-14,16H,7,12,15,17H2,1H3,(H,27,29)