4-[1,3-bis(oxidanylidene)isoindol-2-yl]-N-(6-ethyl-1,3-benzothiazol-2-yl)butanamide

Systemtic Name: 4-[1,3-bis(oxidanylidene)isoindol-2-yl]-N-(6-ethyl-1,3-benzothiazol-2-yl)butanamide Openeye Name: 4-(1,3-dioxoisoindolin-2-yl)-N-(6-ethyl-1,3-benzothiazol-2-yl)butanamide CAS Name: 4-(1,3-dioxo-2-isoindolyl)-N-(6-ethyl-1,3-benzothiazol-2-yl)butanamide IUPAC Name: 4-(1,3-dioxoisoindol-2-yl)-N-(6-ethyl-1,3-benzothiazol-2-yl)butanamide Traditional Name: N-(6-ethyl-1,3-benzothiazol-2-yl)-4-phthalimido-butyramide Formula: C21H19N3O3S MolecularWeight: 393.45886

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Descriptors Computed from Structure

Canonical SMILES:

CCC1=CC2=C(C=C1)N=C(S2)NC(=O)CCCN3C(=O)C4=CC=CC=C4C3=O

Isomeric SMILES

CCC1=CC2=C(C=C1)N=C(S2)NC(=O)CCCN3C(=O)C4=CC=CC=C4C3=O

InChI

InChI=1S/C21H19N3O3S/c1-2-13-9-10-16-17(12-13)28-21(22-16)23-18(25)8-5-11-24-19(26)14-6-3-4-7-15(14)20(24)27/h3-4,6-7,9-10,12H,2,5,8,11H2,1H3,(H,22,23,25)