N-[3-(2-methoxyethyl)-5-nitro-1,3-benzothiazol-2-ylidene]-2-(4-methoxyphenyl)sulfonyl-ethanamide

Systemtic Name: N-[3-(2-methoxyethyl)-5-nitro-1,3-benzothiazol-2-ylidene]-2-(4-methoxyphenyl)sulfonyl-ethanamide Openeye Name: N-[3-(2-methoxyethyl)-5-nitro-1,3-benzothiazol-2-ylidene]-2-(4-methoxyphenyl)sulfonyl-acetamide CAS Name: N-[3-(2-methoxyethyl)-5-nitro-1,3-benzothiazol-2-ylidene]-2-(4-methoxyphenyl)sulfonylacetamide IUPAC Name: N-[3-(2-methoxyethyl)-5-nitro-1,3-benzothiazol-2-ylidene]-2-(4-methoxyphenyl)sulfonylacetamide Traditional Name: N-[3-(2-methoxyethyl)-5-nitro-1,3-benzothiazol-2-ylidene]-2-(4-methoxyphenyl)sulfonyl-acetamide Formula: C19H19N3O7S2 MolecularWeight: 465.50006

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Descriptors Computed from Structure

Canonical SMILES:

COCCN1C2=C(C=CC(=C2)[N+](=O)[O-])SC1=NC(=O)CS(=O)(=O)C3=CC=C(C=C3)OC

Isomeric SMILES

COCCN1C2=C(C=CC(=C2)[N+](=O)[O-])SC1=NC(=O)CS(=O)(=O)C3=CC=C(C=C3)OC

InChI

InChI=1S/C19H19N3O7S2/c1-28-10-9-21-16-11-13(22(24)25)3-8-17(16)30-19(21)20-18(23)12-31(26,27)15-6-4-14(29-2)5-7-15/h3-8,11H,9-10,12H2,1-2H3