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

Systemtic Name: 2-(4-ethylsulfonylphenyl)-N-(3-methyl-5-nitro-1,3-benzothiazol-2-ylidene)ethanamide Openeye Name: 2-(4-ethylsulfonylphenyl)-N-(3-methyl-5-nitro-1,3-benzothiazol-2-ylidene)acetamide CAS Name: 2-(4-ethylsulfonylphenyl)-N-(3-methyl-5-nitro-1,3-benzothiazol-2-ylidene)acetamide IUPAC Name: 2-(4-ethylsulfonylphenyl)-N-(3-methyl-5-nitro-1,3-benzothiazol-2-ylidene)acetamide Traditional Name: 2-(4-esylphenyl)-N-(3-methyl-5-nitro-1,3-benzothiazol-2-ylidene)acetamide Formula: C18H17N3O5S2 MolecularWeight: 419.47468

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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-])C

Isomeric SMILES

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

InChI

InChI=1S/C18H17N3O5S2/c1-3-28(25,26)14-7-4-12(5-8-14)10-17(22)19-18-20(2)15-11-13(21(23)24)6-9-16(15)27-18/h4-9,11H,3,10H2,1-2H3