2-[[6-[1,3-bis(oxidanylidene)isoindol-2-yl]-1,3-benzothiazol-2-yl]sulfanyl]-N-butyl-ethanamide

Systemtic Name: 2-[[6-[1,3-bis(oxidanylidene)isoindol-2-yl]-1,3-benzothiazol-2-yl]sulfanyl]-N-butyl-ethanamide Openeye Name: N-butyl-2-[[6-(1,3-dioxoisoindolin-2-yl)-1,3-benzothiazol-2-yl]sulfanyl]acetamide CAS Name: N-butyl-2-[[6-(1,3-dioxo-2-isoindolyl)-1,3-benzothiazol-2-yl]thio]acetamide IUPAC Name: N-butyl-2-[[6-(1,3-dioxoisoindol-2-yl)-1,3-benzothiazol-2-yl]sulfanyl]acetamide Traditional Name: N-butyl-2-[(6-phthalimido-1,3-benzothiazol-2-yl)thio]acetamide Formula: C21H19N3O3S2 MolecularWeight: 425.52386

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CCCCNC(=O)CSC1=NC2=C(S1)C=C(C=C2)N3C(=O)C4=CC=CC=C4C3=O

Isomeric SMILES

CCCCNC(=O)CSC1=NC2=C(S1)C=C(C=C2)N3C(=O)C4=CC=CC=C4C3=O

InChI

InChI=1S/C21H19N3O3S2/c1-2-3-10-22-18(25)12-28-21-23-16-9-8-13(11-17(16)29-21)24-19(26)14-6-4-5-7-15(14)20(24)27/h4-9,11H,2-3,10,12H2,1H3,(H,22,25)