N-(3-ethyl-5-nitro-1,3-benzothiazol-2-ylidene)-2-(4-ethylsulfonylphenyl)ethanamide

Systemtic Name: N-(3-ethyl-5-nitro-1,3-benzothiazol-2-ylidene)-2-(4-ethylsulfonylphenyl)ethanamide Openeye Name: N-(3-ethyl-5-nitro-1,3-benzothiazol-2-ylidene)-2-(4-ethylsulfonylphenyl)acetamide CAS Name: N-(3-ethyl-5-nitro-1,3-benzothiazol-2-ylidene)-2-(4-ethylsulfonylphenyl)acetamide IUPAC Name: N-(3-ethyl-5-nitro-1,3-benzothiazol-2-ylidene)-2-(4-ethylsulfonylphenyl)acetamide Traditional Name: 2-(4-esylphenyl)-N-(3-ethyl-5-nitro-1,3-benzothiazol-2-ylidene)acetamide Formula: C19H19N3O5S2 MolecularWeight: 433.50126

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Descriptors Computed from Structure

Canonical SMILES:

CCN1C2=C(C=CC(=C2)[N+](=O)[O-])SC1=NC(=O)CC3=CC=C(C=C3)S(=O)(=O)CC

Isomeric SMILES

CCN1C2=C(C=CC(=C2)[N+](=O)[O-])SC1=NC(=O)CC3=CC=C(C=C3)S(=O)(=O)CC

InChI

InChI=1S/C19H19N3O5S2/c1-3-21-16-12-14(22(24)25)7-10-17(16)28-19(21)20-18(23)11-13-5-8-15(9-6-13)29(26,27)4-2/h5-10,12H,3-4,11H2,1-2H3