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

Systemtic Name: 4-[bis(2-cyanoethyl)sulfamoyl]-N-[3-(2-methoxyethyl)-6-nitro-1,3-benzothiazol-2-ylidene]benzamide Openeye Name: 4-[bis(2-cyanoethyl)sulfamoyl]-N-[3-(2-methoxyethyl)-6-nitro-1,3-benzothiazol-2-ylidene]benzamide CAS Name: 4-[bis(2-cyanoethyl)sulfamoyl]-N-[3-(2-methoxyethyl)-6-nitro-1,3-benzothiazol-2-ylidene]benzamide IUPAC Name: 4-[bis(2-cyanoethyl)sulfamoyl]-N-[3-(2-methoxyethyl)-6-nitro-1,3-benzothiazol-2-ylidene]benzamide Traditional Name: 4-[bis(2-cyanoethyl)sulfamoyl]-N-[3-(2-methoxyethyl)-6-nitro-1,3-benzothiazol-2-ylidene]benzamide Formula: C23H22N6O6S2 MolecularWeight: 542.58738

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Descriptors Computed from Structure

Canonical SMILES:

COCCN1C2=C(C=C(C=C2)[N+](=O)[O-])SC1=NC(=O)C3=CC=C(C=C3)S(=O)(=O)N(CCC#N)CCC#N

Isomeric SMILES

COCCN1C2=C(C=C(C=C2)[N+](=O)[O-])SC1=NC(=O)C3=CC=C(C=C3)S(=O)(=O)N(CCC#N)CCC#N

InChI

InChI=1S/C23H22N6O6S2/c1-35-15-14-28-20-9-6-18(29(31)32)16-21(20)36-23(28)26-22(30)17-4-7-19(8-5-17)37(33,34)27(12-2-10-24)13-3-11-25/h4-9,16H,2-3,12-15H2,1H3