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

Systemtic Name: N-(6-bromanyl-3-prop-2-ynyl-1,3-benzothiazol-2-ylidene)-2-(2-oxidanylidene-2-piperidin-1-yl-ethyl)sulfonyl-ethanamide Openeye Name: N-(6-bromo-3-prop-2-ynyl-1,3-benzothiazol-2-ylidene)-2-[2-oxo-2-(1-piperidyl)ethyl]sulfonyl-acetamide CAS Name: N-(6-bromo-3-prop-2-ynyl-1,3-benzothiazol-2-ylidene)-2-[2-oxo-2-(1-piperidinyl)ethyl]sulfonylacetamide IUPAC Name: N-(6-bromo-3-prop-2-ynyl-1,3-benzothiazol-2-ylidene)-2-(2-oxo-2-piperidin-1-ylethyl)sulfonylacetamide Traditional Name: N-(6-bromo-3-propargyl-1,3-benzothiazol-2-ylidene)-2-(2-keto-2-piperidino-ethyl)sulfonyl-acetamide Formula: C19H20BrN3O4S2 MolecularWeight: 498.4138

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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)N3CCCCC3

Isomeric SMILES

C#CCN1C2=C(C=C(C=C2)Br)SC1=NC(=O)CS(=O)(=O)CC(=O)N3CCCCC3

InChI

InChI=1S/C19H20BrN3O4S2/c1-2-8-23-15-7-6-14(20)11-16(15)28-19(23)21-17(24)12-29(26,27)13-18(25)22-9-4-3-5-10-22/h1,6-7,11H,3-5,8-10,12-13H2