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

Systemtic Name: 2-[1,3-bis(oxidanylidene)isoindol-2-yl]-3-methyl-N-(6-methyl-1,3-benzothiazol-2-yl)butanamide Openeye Name: 2-(1,3-dioxoisoindolin-2-yl)-3-methyl-N-(6-methyl-1,3-benzothiazol-2-yl)butanamide CAS Name: 2-(1,3-dioxo-2-isoindolyl)-3-methyl-N-(6-methyl-1,3-benzothiazol-2-yl)butanamide IUPAC Name: 2-(1,3-dioxoisoindol-2-yl)-3-methyl-N-(6-methyl-1,3-benzothiazol-2-yl)butanamide Traditional Name: 3-methyl-N-(6-methyl-1,3-benzothiazol-2-yl)-2-phthalimido-butyramide Formula: C21H19N3O3S MolecularWeight: 393.45886

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CC1=CC2=C(C=C1)N=C(S2)NC(=O)C(C(C)C)N3C(=O)C4=CC=CC=C4C3=O

Isomeric SMILES

CC1=CC2=C(C=C1)N=C(S2)NC(=O)C(C(C)C)N3C(=O)C4=CC=CC=C4C3=O

InChI

InChI=1S/C21H19N3O3S/c1-11(2)17(24-19(26)13-6-4-5-7-14(13)20(24)27)18(25)23-21-22-15-9-8-12(3)10-16(15)28-21/h4-11,17H,1-3H3,(H,22,23,25)