N-(6-bromanyl-3-prop-2-ynyl-1,3-benzothiazol-2-ylidene)-2-(2-morpholin-4-yl-2-oxidanylidene-ethyl)sulfonyl-ethanamide

Systemtic Name: N-(6-bromanyl-3-prop-2-ynyl-1,3-benzothiazol-2-ylidene)-2-(2-morpholin-4-yl-2-oxidanylidene-ethyl)sulfonyl-ethanamide Openeye Name: N-(6-bromo-3-prop-2-ynyl-1,3-benzothiazol-2-ylidene)-2-(2-morpholino-2-oxo-ethyl)sulfonyl-acetamide CAS Name: N-(6-bromo-3-prop-2-ynyl-1,3-benzothiazol-2-ylidene)-2-[2-(4-morpholinyl)-2-oxoethyl]sulfonylacetamide IUPAC Name: N-(6-bromo-3-prop-2-ynyl-1,3-benzothiazol-2-ylidene)-2-(2-morpholin-4-yl-2-oxoethyl)sulfonylacetamide Traditional Name: N-(6-bromo-3-propargyl-1,3-benzothiazol-2-ylidene)-2-(2-keto-2-morpholino-ethyl)sulfonyl-acetamide Formula: C18H18BrN3O5S2 MolecularWeight: 500.38662

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Descriptors Computed from Structure

Canonical SMILES:

C#CCN1C2=C(C=C(C=C2)Br)SC1=NC(=O)CS(=O)(=O)CC(=O)N3CCOCC3

Isomeric SMILES

C#CCN1C2=C(C=C(C=C2)Br)SC1=NC(=O)CS(=O)(=O)CC(=O)N3CCOCC3

InChI

InChI=1S/C18H18BrN3O5S2/c1-2-5-22-14-4-3-13(19)10-15(14)28-18(22)20-16(23)11-29(25,26)12-17(24)21-6-8-27-9-7-21/h1,3-4,10H,5-9,11-12H2