N-(3-prop-2-ynyl-6-sulfamoyl-1,3-benzothiazol-2-ylidene)-9H-xanthene-9-carboxamide

Systemtic Name: N-(3-prop-2-ynyl-6-sulfamoyl-1,3-benzothiazol-2-ylidene)-9H-xanthene-9-carboxamide Openeye Name: N-(3-prop-2-ynyl-6-sulfamoyl-1,3-benzothiazol-2-ylidene)-9H-xanthene-9-carboxamide CAS Name: N-(3-prop-2-ynyl-6-sulfamoyl-1,3-benzothiazol-2-ylidene)-9H-xanthene-9-carboxamide IUPAC Name: N-(3-prop-2-ynyl-6-sulfamoyl-1,3-benzothiazol-2-ylidene)-9H-xanthene-9-carboxamide Traditional Name: N-(3-propargyl-6-sulfamoyl-1,3-benzothiazol-2-ylidene)-9H-xanthene-9-carboxamide Formula: C24H17N3O4S2 MolecularWeight: 475.53948

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Descriptors Computed from Structure

Canonical SMILES:

C#CCN1C2=C(C=C(C=C2)S(=O)(=O)N)SC1=NC(=O)C3C4=CC=CC=C4OC5=CC=CC=C35

Isomeric SMILES

C#CCN1C2=C(C=C(C=C2)S(=O)(=O)N)SC1=NC(=O)C3C4=CC=CC=C4OC5=CC=CC=C35

InChI

InChI=1S/C24H17N3O4S2/c1-2-13-27-18-12-11-15(33(25,29)30)14-21(18)32-24(27)26-23(28)22-16-7-3-5-9-19(16)31-20-10-6-4-8-17(20)22/h1,3-12,14,22H,13H2,(H2,25,29,30)