4,5-dimethoxy-2-nitro-N-(3-prop-2-ynyl-6-sulfamoyl-1,3-benzothiazol-2-ylidene)benzamide

Systemtic Name: 4,5-dimethoxy-2-nitro-N-(3-prop-2-ynyl-6-sulfamoyl-1,3-benzothiazol-2-ylidene)benzamide Openeye Name: 4,5-dimethoxy-2-nitro-N-(3-prop-2-ynyl-6-sulfamoyl-1,3-benzothiazol-2-ylidene)benzamide CAS Name: 4,5-dimethoxy-2-nitro-N-(3-prop-2-ynyl-6-sulfamoyl-1,3-benzothiazol-2-ylidene)benzamide IUPAC Name: 4,5-dimethoxy-2-nitro-N-(3-prop-2-ynyl-6-sulfamoyl-1,3-benzothiazol-2-ylidene)benzamide Traditional Name: 4,5-dimethoxy-2-nitro-N-(3-propargyl-6-sulfamoyl-1,3-benzothiazol-2-ylidene)benzamide Formula: C19H16N4O7S2 MolecularWeight: 476.48294

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Descriptors Computed from Structure

Canonical SMILES:

COC1=C(C=C(C(=C1)C(=O)N=C2N(C3=C(S2)C=C(C=C3)S(=O)(=O)N)CC#C)[N+](=O)[O-])OC

Isomeric SMILES

COC1=C(C=C(C(=C1)C(=O)N=C2N(C3=C(S2)C=C(C=C3)S(=O)(=O)N)CC#C)[N+](=O)[O-])OC

InChI

InChI=1S/C19H16N4O7S2/c1-4-7-22-13-6-5-11(32(20,27)28)8-17(13)31-19(22)21-18(24)12-9-15(29-2)16(30-3)10-14(12)23(25)26/h1,5-6,8-10H,7H2,2-3H3,(H2,20,27,28)