4-[bis(2-cyanoethyl)sulfamoyl]-N-[4-(4-methylphenyl)-1,3-thiazol-2-yl]benzamide

Systemtic Name: 4-[bis(2-cyanoethyl)sulfamoyl]-N-[4-(4-methylphenyl)-1,3-thiazol-2-yl]benzamide Openeye Name: 4-[bis(2-cyanoethyl)sulfamoyl]-N-[4-(p-tolyl)thiazol-2-yl]benzamide CAS Name: 4-[bis(2-cyanoethyl)sulfamoyl]-N-[4-(4-methylphenyl)-2-thiazolyl]benzamide IUPAC Name: 4-[bis(2-cyanoethyl)sulfamoyl]-N-[4-(4-methylphenyl)-1,3-thiazol-2-yl]benzamide Traditional Name: 4-[bis(2-cyanoethyl)sulfamoyl]-N-[4-(p-tolyl)thiazol-2-yl]benzamide Formula: C23H21N5O3S2 MolecularWeight: 479.57454

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC=C(C=C1)C2=CSC(=N2)NC(=O)C3=CC=C(C=C3)S(=O)(=O)N(CCC#N)CCC#N

Isomeric SMILES

CC1=CC=C(C=C1)C2=CSC(=N2)NC(=O)C3=CC=C(C=C3)S(=O)(=O)N(CCC#N)CCC#N

InChI

InChI=1S/C23H21N5O3S2/c1-17-4-6-18(7-5-17)21-16-32-23(26-21)27-22(29)19-8-10-20(11-9-19)33(30,31)28(14-2-12-24)15-3-13-25/h4-11,16H,2-3,14-15H2,1H3,(H,26,27,29)