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

Systemtic Name: N-[3-(2-ethoxyethyl)-5-nitro-1,3-benzothiazol-2-ylidene]-2-(4-methoxyphenyl)sulfonyl-ethanamide Openeye Name: N-[3-(2-ethoxyethyl)-5-nitro-1,3-benzothiazol-2-ylidene]-2-(4-methoxyphenyl)sulfonyl-acetamide CAS Name: N-[3-(2-ethoxyethyl)-5-nitro-1,3-benzothiazol-2-ylidene]-2-(4-methoxyphenyl)sulfonylacetamide IUPAC Name: N-[3-(2-ethoxyethyl)-5-nitro-1,3-benzothiazol-2-ylidene]-2-(4-methoxyphenyl)sulfonylacetamide Traditional Name: N-[3-(2-ethoxyethyl)-5-nitro-1,3-benzothiazol-2-ylidene]-2-(4-methoxyphenyl)sulfonyl-acetamide Formula: C20H21N3O7S2 MolecularWeight: 479.52664

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Descriptors Computed from Structure

Canonical SMILES:

CCOCCN1C2=C(C=CC(=C2)[N+](=O)[O-])SC1=NC(=O)CS(=O)(=O)C3=CC=C(C=C3)OC

Isomeric SMILES

CCOCCN1C2=C(C=CC(=C2)[N+](=O)[O-])SC1=NC(=O)CS(=O)(=O)C3=CC=C(C=C3)OC

InChI

InChI=1S/C20H21N3O7S2/c1-3-30-11-10-22-17-12-14(23(25)26)4-9-18(17)31-20(22)21-19(24)13-32(27,28)16-7-5-15(29-2)6-8-16/h4-9,12H,3,10-11,13H2,1-2H3