4-[bis(2-cyanoethyl)sulfamoyl]-N-[3-(2-methoxyethyl)-6-methylsulfonyl-1,3-benzothiazol-2-ylidene]benzamide

Systemtic Name: 4-[bis(2-cyanoethyl)sulfamoyl]-N-[3-(2-methoxyethyl)-6-methylsulfonyl-1,3-benzothiazol-2-ylidene]benzamide Openeye Name: 4-[bis(2-cyanoethyl)sulfamoyl]-N-[3-(2-methoxyethyl)-6-methylsulfonyl-1,3-benzothiazol-2-ylidene]benzamide CAS Name: 4-[bis(2-cyanoethyl)sulfamoyl]-N-[3-(2-methoxyethyl)-6-methylsulfonyl-1,3-benzothiazol-2-ylidene]benzamide IUPAC Name: 4-[bis(2-cyanoethyl)sulfamoyl]-N-[3-(2-methoxyethyl)-6-methylsulfonyl-1,3-benzothiazol-2-ylidene]benzamide Traditional Name: 4-[bis(2-cyanoethyl)sulfamoyl]-N-[6-mesyl-3-(2-methoxyethyl)-1,3-benzothiazol-2-ylidene]benzamide Formula: C24H25N5O6S3 MolecularWeight: 575.6802

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Descriptors Computed from Structure

Canonical SMILES:

COCCN1C2=C(C=C(C=C2)S(=O)(=O)C)SC1=NC(=O)C3=CC=C(C=C3)S(=O)(=O)N(CCC#N)CCC#N

Isomeric SMILES

COCCN1C2=C(C=C(C=C2)S(=O)(=O)C)SC1=NC(=O)C3=CC=C(C=C3)S(=O)(=O)N(CCC#N)CCC#N

InChI

InChI=1S/C24H25N5O6S3/c1-35-16-15-29-21-10-9-20(37(2,31)32)17-22(21)36-24(29)27-23(30)18-5-7-19(8-6-18)38(33,34)28(13-3-11-25)14-4-12-26/h5-10,17H,3-4,13-16H2,1-2H3