6-[1,3-bis(oxidanylidene)isoindol-2-yl]-N-(2-methyl-1,3-benzothiazol-6-yl)hexanamide

Systemtic Name: 6-[1,3-bis(oxidanylidene)isoindol-2-yl]-N-(2-methyl-1,3-benzothiazol-6-yl)hexanamide Openeye Name: 6-(1,3-dioxoisoindolin-2-yl)-N-(2-methyl-1,3-benzothiazol-6-yl)hexanamide CAS Name: 6-(1,3-dioxo-2-isoindolyl)-N-(2-methyl-1,3-benzothiazol-6-yl)hexanamide IUPAC Name: 6-(1,3-dioxoisoindol-2-yl)-N-(2-methyl-1,3-benzothiazol-6-yl)hexanamide Traditional Name: N-(2-methyl-1,3-benzothiazol-6-yl)-6-phthalimido-hexanamide Formula: C22H21N3O3S MolecularWeight: 407.48544

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Descriptors Computed from Structure

Canonical SMILES:

CC1=NC2=C(S1)C=C(C=C2)NC(=O)CCCCCN3C(=O)C4=CC=CC=C4C3=O

Isomeric SMILES

CC1=NC2=C(S1)C=C(C=C2)NC(=O)CCCCCN3C(=O)C4=CC=CC=C4C3=O

InChI

InChI=1S/C22H21N3O3S/c1-14-23-18-11-10-15(13-19(18)29-14)24-20(26)9-3-2-6-12-25-21(27)16-7-4-5-8-17(16)22(25)28/h4-5,7-8,10-11,13H,2-3,6,9,12H2,1H3,(H,24,26)