N-(3-ethyl-6-nitro-1,3-benzothiazol-2-ylidene)-2-(4-methoxyphenyl)sulfonyl-ethanamide

Systemtic Name: N-(3-ethyl-6-nitro-1,3-benzothiazol-2-ylidene)-2-(4-methoxyphenyl)sulfonyl-ethanamide Openeye Name: N-(3-ethyl-6-nitro-1,3-benzothiazol-2-ylidene)-2-(4-methoxyphenyl)sulfonyl-acetamide CAS Name: N-(3-ethyl-6-nitro-1,3-benzothiazol-2-ylidene)-2-(4-methoxyphenyl)sulfonylacetamide IUPAC Name: N-(3-ethyl-6-nitro-1,3-benzothiazol-2-ylidene)-2-(4-methoxyphenyl)sulfonylacetamide Traditional Name: N-(3-ethyl-6-nitro-1,3-benzothiazol-2-ylidene)-2-(4-methoxyphenyl)sulfonyl-acetamide Formula: C18H17N3O6S2 MolecularWeight: 435.47408

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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)C3=CC=C(C=C3)OC

Isomeric SMILES

CCN1C2=C(C=C(C=C2)[N+](=O)[O-])SC1=NC(=O)CS(=O)(=O)C3=CC=C(C=C3)OC

InChI

InChI=1S/C18H17N3O6S2/c1-3-20-15-9-4-12(21(23)24)10-16(15)28-18(20)19-17(22)11-29(25,26)14-7-5-13(27-2)6-8-14/h4-10H,3,11H2,1-2H3