2-[2-(azepan-1-yl)-2-oxidanylidene-ethyl]sulfonyl-N-(6-bromanyl-3-ethyl-1,3-benzothiazol-2-ylidene)ethanamide

Systemtic Name: 2-[2-(azepan-1-yl)-2-oxidanylidene-ethyl]sulfonyl-N-(6-bromanyl-3-ethyl-1,3-benzothiazol-2-ylidene)ethanamide Openeye Name: 2-[2-(azepan-1-yl)-2-oxo-ethyl]sulfonyl-N-(6-bromo-3-ethyl-1,3-benzothiazol-2-ylidene)acetamide CAS Name: 2-[2-(1-azepanyl)-2-oxoethyl]sulfonyl-N-(6-bromo-3-ethyl-1,3-benzothiazol-2-ylidene)acetamide IUPAC Name: 2-[2-(azepan-1-yl)-2-oxoethyl]sulfonyl-N-(6-bromo-3-ethyl-1,3-benzothiazol-2-ylidene)acetamide Traditional Name: 2-[2-(azepan-1-yl)-2-keto-ethyl]sulfonyl-N-(6-bromo-3-ethyl-1,3-benzothiazol-2-ylidene)acetamide Formula: C19H24BrN3O4S2 MolecularWeight: 502.44556

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Descriptors Computed from Structure

Canonical SMILES:

CCN1C2=C(C=C(C=C2)Br)SC1=NC(=O)CS(=O)(=O)CC(=O)N3CCCCCC3

Isomeric SMILES

CCN1C2=C(C=C(C=C2)Br)SC1=NC(=O)CS(=O)(=O)CC(=O)N3CCCCCC3

InChI

InChI=1S/C19H24BrN3O4S2/c1-2-23-15-8-7-14(20)11-16(15)28-19(23)21-17(24)12-29(26,27)13-18(25)22-9-5-3-4-6-10-22/h7-8,11H,2-6,9-10,12-13H2,1H3