4-[4-[4-(2,5-dimethylpyrrol-1-yl)phenyl]carbonylpiperazin-1-yl]sulfonylbenzenesulfonamide

Systemtic Name: 4-[4-[4-(2,5-dimethylpyrrol-1-yl)phenyl]carbonylpiperazin-1-yl]sulfonylbenzenesulfonamide Openeye Name: 4-[4-[4-(2,5-dimethylpyrrol-1-yl)benzoyl]piperazin-1-yl]sulfonylbenzenesulfonamide CAS Name: 4-[[4-[[4-(2,5-dimethyl-1-pyrrolyl)phenyl]-oxomethyl]-1-piperazinyl]sulfonyl]benzenesulfonamide IUPAC Name: 4-[4-[4-(2,5-dimethylpyrrol-1-yl)benzoyl]piperazin-1-yl]sulfonylbenzenesulfonamide Traditional Name: 4-[4-[4-(2,5-dimethylpyrrol-1-yl)benzoyl]piperazino]sulfonylbenzenesulfonamide Formula: C23H26N4O5S2 MolecularWeight: 502.60634

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC=C(N1C2=CC=C(C=C2)C(=O)N3CCN(CC3)S(=O)(=O)C4=CC=C(C=C4)S(=O)(=O)N)C

Isomeric SMILES

CC1=CC=C(N1C2=CC=C(C=C2)C(=O)N3CCN(CC3)S(=O)(=O)C4=CC=C(C=C4)S(=O)(=O)N)C

InChI

InChI=1S/C23H26N4O5S2/c1-17-3-4-18(2)27(17)20-7-5-19(6-8-20)23(28)25-13-15-26(16-14-25)34(31,32)22-11-9-21(10-12-22)33(24,29)30/h3-12H,13-16H2,1-2H3,(H2,24,29,30)