N-(6-bromanyl-3-ethyl-1,3-benzothiazol-2-ylidene)-4-(phenylsulfonyl)butanamide

Systemtic Name: N-(6-bromanyl-3-ethyl-1,3-benzothiazol-2-ylidene)-4-(phenylsulfonyl)butanamide Openeye Name: 4-(benzenesulfonyl)-N-(6-bromo-3-ethyl-1,3-benzothiazol-2-ylidene)butanamide CAS Name: 4-(benzenesulfonyl)-N-(6-bromo-3-ethyl-1,3-benzothiazol-2-ylidene)butanamide IUPAC Name: 4-(benzenesulfonyl)-N-(6-bromo-3-ethyl-1,3-benzothiazol-2-ylidene)butanamide Traditional Name: 4-besyl-N-(6-bromo-3-ethyl-1,3-benzothiazol-2-ylidene)butyramide Formula: C19H19BrN2O3S2 MolecularWeight: 467.39976

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Descriptors Computed from Structure

Canonical SMILES:

CCN1C2=C(C=C(C=C2)Br)SC1=NC(=O)CCCS(=O)(=O)C3=CC=CC=C3

Isomeric SMILES

CCN1C2=C(C=C(C=C2)Br)SC1=NC(=O)CCCS(=O)(=O)C3=CC=CC=C3

InChI

InChI=1S/C19H19BrN2O3S2/c1-2-22-16-11-10-14(20)13-17(16)26-19(22)21-18(23)9-6-12-27(24,25)15-7-4-3-5-8-15/h3-5,7-8,10-11,13H,2,6,9,12H2,1H3