4-[bis(2-cyanoethyl)sulfamoyl]-N-(6-chloranyl-4-methyl-1,3-benzothiazol-2-yl)benzamide

Systemtic Name: 4-[bis(2-cyanoethyl)sulfamoyl]-N-(6-chloranyl-4-methyl-1,3-benzothiazol-2-yl)benzamide Openeye Name: 4-[bis(2-cyanoethyl)sulfamoyl]-N-(6-chloro-4-methyl-1,3-benzothiazol-2-yl)benzamide CAS Name: 4-[bis(2-cyanoethyl)sulfamoyl]-N-(6-chloro-4-methyl-1,3-benzothiazol-2-yl)benzamide IUPAC Name: 4-[bis(2-cyanoethyl)sulfamoyl]-N-(6-chloro-4-methyl-1,3-benzothiazol-2-yl)benzamide Traditional Name: 4-[bis(2-cyanoethyl)sulfamoyl]-N-(6-chloro-4-methyl-1,3-benzothiazol-2-yl)benzamide Formula: C21H18ClN5O3S2 MolecularWeight: 487.98232

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC(=CC2=C1N=C(S2)NC(=O)C3=CC=C(C=C3)S(=O)(=O)N(CCC#N)CCC#N)Cl

Isomeric SMILES

CC1=CC(=CC2=C1N=C(S2)NC(=O)C3=CC=C(C=C3)S(=O)(=O)N(CCC#N)CCC#N)Cl

InChI

InChI=1S/C21H18ClN5O3S2/c1-14-12-16(22)13-18-19(14)25-21(31-18)26-20(28)15-4-6-17(7-5-15)32(29,30)27(10-2-8-23)11-3-9-24/h4-7,12-13H,2-3,10-11H2,1H3,(H,25,26,28)