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

Systemtic Name: N-(1H-benzimidazol-2-yl)-2-[1,3-bis(oxidanylidene)isoindol-2-yl]-4-methylsulfanyl-butanamide Openeye Name: N-(1H-benzimidazol-2-yl)-2-(1,3-dioxoisoindolin-2-yl)-4-methylsulfanyl-butanamide CAS Name: N-(1H-benzimidazol-2-yl)-2-(1,3-dioxo-2-isoindolyl)-4-(methylthio)butanamide IUPAC Name: N-(1H-benzimidazol-2-yl)-2-(1,3-dioxoisoindol-2-yl)-4-methylsulfanylbutanamide Traditional Name: N-(1H-benzimidazol-2-yl)-4-(methylthio)-2-phthalimido-butyramide Formula: C20H18N4O3S MolecularWeight: 394.44692

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CSCCC(C(=O)NC1=NC2=CC=CC=C2N1)N3C(=O)C4=CC=CC=C4C3=O

Isomeric SMILES

CSCCC(C(=O)NC1=NC2=CC=CC=C2N1)N3C(=O)C4=CC=CC=C4C3=O

InChI

InChI=1S/C20H18N4O3S/c1-28-11-10-16(24-18(26)12-6-2-3-7-13(12)19(24)27)17(25)23-20-21-14-8-4-5-9-15(14)22-20/h2-9,16H,10-11H2,1H3,(H2,21,22,23,25)