4-(2-cyanoethylsulfamoyl)-N-(5,6-dimethoxy-1,3-benzothiazol-2-yl)benzamide

Systemtic Name: 4-(2-cyanoethylsulfamoyl)-N-(5,6-dimethoxy-1,3-benzothiazol-2-yl)benzamide Openeye Name: 4-(2-cyanoethylsulfamoyl)-N-(5,6-dimethoxy-1,3-benzothiazol-2-yl)benzamide CAS Name: 4-(2-cyanoethylsulfamoyl)-N-(5,6-dimethoxy-1,3-benzothiazol-2-yl)benzamide IUPAC Name: 4-(2-cyanoethylsulfamoyl)-N-(5,6-dimethoxy-1,3-benzothiazol-2-yl)benzamide Traditional Name: 4-(2-cyanoethylsulfamoyl)-N-(5,6-dimethoxy-1,3-benzothiazol-2-yl)benzamide Formula: C19H18N4O5S2 MolecularWeight: 446.50002

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Descriptors Computed from Structure

Canonical SMILES:

COC1=C(C=C2C(=C1)N=C(S2)NC(=O)C3=CC=C(C=C3)S(=O)(=O)NCCC#N)OC

Isomeric SMILES

COC1=C(C=C2C(=C1)N=C(S2)NC(=O)C3=CC=C(C=C3)S(=O)(=O)NCCC#N)OC

InChI

InChI=1S/C19H18N4O5S2/c1-27-15-10-14-17(11-16(15)28-2)29-19(22-14)23-18(24)12-4-6-13(7-5-12)30(25,26)21-9-3-8-20/h4-7,10-11,21H,3,9H2,1-2H3,(H,22,23,24)