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

Systemtic Name: N-(6-bromanyl-3-ethyl-1,3-benzothiazol-2-ylidene)-2-[2-(3-methylpiperidin-1-yl)-2-oxidanylidene-ethyl]sulfonyl-ethanamide Openeye Name: N-(6-bromo-3-ethyl-1,3-benzothiazol-2-ylidene)-2-[2-(3-methyl-1-piperidyl)-2-oxo-ethyl]sulfonyl-acetamide CAS Name: N-(6-bromo-3-ethyl-1,3-benzothiazol-2-ylidene)-2-[2-(3-methyl-1-piperidinyl)-2-oxoethyl]sulfonylacetamide IUPAC Name: N-(6-bromo-3-ethyl-1,3-benzothiazol-2-ylidene)-2-[2-(3-methylpiperidin-1-yl)-2-oxoethyl]sulfonylacetamide Traditional Name: N-(6-bromo-3-ethyl-1,3-benzothiazol-2-ylidene)-2-[2-keto-2-(3-methylpiperidino)ethyl]sulfonyl-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)N3CCCC(C3)C

Isomeric SMILES

CCN1C2=C(C=C(C=C2)Br)SC1=NC(=O)CS(=O)(=O)CC(=O)N3CCCC(C3)C

InChI

InChI=1S/C19H24BrN3O4S2/c1-3-23-15-7-6-14(20)9-16(15)28-19(23)21-17(24)11-29(26,27)12-18(25)22-8-4-5-13(2)10-22/h6-7,9,13H,3-5,8,10-12H2,1-2H3