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

Systemtic Name: N-(3-ethyl-6-nitro-1,3-benzothiazol-2-ylidene)-2-(2-oxidanylidene-2-piperidin-1-yl-ethyl)sulfonyl-ethanamide Openeye Name: N-(3-ethyl-6-nitro-1,3-benzothiazol-2-ylidene)-2-[2-oxo-2-(1-piperidyl)ethyl]sulfonyl-acetamide CAS Name: N-(3-ethyl-6-nitro-1,3-benzothiazol-2-ylidene)-2-[2-oxo-2-(1-piperidinyl)ethyl]sulfonylacetamide IUPAC Name: N-(3-ethyl-6-nitro-1,3-benzothiazol-2-ylidene)-2-(2-oxo-2-piperidin-1-ylethyl)sulfonylacetamide Traditional Name: N-(3-ethyl-6-nitro-1,3-benzothiazol-2-ylidene)-2-(2-keto-2-piperidino-ethyl)sulfonyl-acetamide Formula: C18H22N4O6S2 MolecularWeight: 454.52048

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Descriptors Computed from Structure

Canonical SMILES:

CCN1C2=C(C=C(C=C2)[N+](=O)[O-])SC1=NC(=O)CS(=O)(=O)CC(=O)N3CCCCC3

Isomeric SMILES

CCN1C2=C(C=C(C=C2)[N+](=O)[O-])SC1=NC(=O)CS(=O)(=O)CC(=O)N3CCCCC3

InChI

InChI=1S/C18H22N4O6S2/c1-2-21-14-7-6-13(22(25)26)10-15(14)29-18(21)19-16(23)11-30(27,28)12-17(24)20-8-4-3-5-9-20/h6-7,10H,2-5,8-9,11-12H2,1H3