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

Systemtic Name: 2-(4-ethylsulfonylphenyl)-N-[3-(2-methoxyethyl)-5-nitro-1,3-benzothiazol-2-ylidene]ethanamide Openeye Name: 2-(4-ethylsulfonylphenyl)-N-[3-(2-methoxyethyl)-5-nitro-1,3-benzothiazol-2-ylidene]acetamide CAS Name: 2-(4-ethylsulfonylphenyl)-N-[3-(2-methoxyethyl)-5-nitro-1,3-benzothiazol-2-ylidene]acetamide IUPAC Name: 2-(4-ethylsulfonylphenyl)-N-[3-(2-methoxyethyl)-5-nitro-1,3-benzothiazol-2-ylidene]acetamide Traditional Name: 2-(4-esylphenyl)-N-[3-(2-methoxyethyl)-5-nitro-1,3-benzothiazol-2-ylidene]acetamide Formula: C20H21N3O6S2 MolecularWeight: 463.52724

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Descriptors Computed from Structure

Canonical SMILES:

CCS(=O)(=O)C1=CC=C(C=C1)CC(=O)N=C2N(C3=C(S2)C=CC(=C3)[N+](=O)[O-])CCOC

Isomeric SMILES

CCS(=O)(=O)C1=CC=C(C=C1)CC(=O)N=C2N(C3=C(S2)C=CC(=C3)[N+](=O)[O-])CCOC

InChI

InChI=1S/C20H21N3O6S2/c1-3-31(27,28)16-7-4-14(5-8-16)12-19(24)21-20-22(10-11-29-2)17-13-15(23(25)26)6-9-18(17)30-20/h4-9,13H,3,10-12H2,1-2H3