N1,N4-bis[4-[(3,4-dimethylphenyl)sulfamoyl]phenyl]benzene-1,4-dicarboxamide

Systemtic Name: N1,N4-bis[4-[(3,4-dimethylphenyl)sulfamoyl]phenyl]benzene-1,4-dicarboxamide Openeye Name: N1,N4-bis[4-[(3,4-dimethylphenyl)sulfamoyl]phenyl]terephthalamide CAS Name: N1,N4-bis[4-[(3,4-dimethylphenyl)sulfamoyl]phenyl]benzene-1,4-dicarboxamide IUPAC Name: 1-N,4-N-bis[4-[(3,4-dimethylphenyl)sulfamoyl]phenyl]benzene-1,4-dicarboxamide Traditional Name: N,N'-bis[4-[(3,4-dimethylphenyl)sulfamoyl]phenyl]terephthalamide Formula: C36H34N4O6S2 MolecularWeight: 682.80836

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C(C=C(C=C1)NS(=O)(=O)C2=CC=C(C=C2)NC(=O)C3=CC=C(C=C3)C(=O)NC4=CC=C(C=C4)S(=O)(=O)NC5=CC(=C(C=C5)C)C)C

Isomeric SMILES

CC1=C(C=C(C=C1)NS(=O)(=O)C2=CC=C(C=C2)NC(=O)C3=CC=C(C=C3)C(=O)NC4=CC=C(C=C4)S(=O)(=O)NC5=CC(=C(C=C5)C)C)C

InChI

InChI=1S/C36H34N4O6S2/c1-23-5-11-31(21-25(23)3)39-47(43,44)33-17-13-29(14-18-33)37-35(41)27-7-9-28(10-8-27)36(42)38-30-15-19-34(20-16-30)48(45,46)40-32-12-6-24(2)26(4)22-32/h5-22,39-40H,1-4H3,(H,37,41)(H,38,42)