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

Systemtic Name: 4-[1,3-bis(oxidanylidene)isoindol-2-yl]-N-(6-bromanyl-1,3-benzothiazol-2-yl)butanamide Openeye Name: N-(6-bromo-1,3-benzothiazol-2-yl)-4-(1,3-dioxoisoindolin-2-yl)butanamide CAS Name: N-(6-bromo-1,3-benzothiazol-2-yl)-4-(1,3-dioxo-2-isoindolyl)butanamide IUPAC Name: N-(6-bromo-1,3-benzothiazol-2-yl)-4-(1,3-dioxoisoindol-2-yl)butanamide Traditional Name: N-(6-bromo-1,3-benzothiazol-2-yl)-4-phthalimido-butyramide Formula: C19H14BrN3O3S MolecularWeight: 444.30176

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC=C2C(=C1)C(=O)N(C2=O)CCCC(=O)NC3=NC4=C(S3)C=C(C=C4)Br

Isomeric SMILES

C1=CC=C2C(=C1)C(=O)N(C2=O)CCCC(=O)NC3=NC4=C(S3)C=C(C=C4)Br

InChI

InChI=1S/C19H14BrN3O3S/c20-11-7-8-14-15(10-11)27-19(21-14)22-16(24)6-3-9-23-17(25)12-4-1-2-5-13(12)18(23)26/h1-2,4-5,7-8,10H,3,6,9H2,(H,21,22,24)