[4-(4-bromophenyl)sulfonylpiperazin-1-yl]-[4-(2,5-dimethylpyrrol-1-yl)phenyl]methanone

Systemtic Name: [4-(4-bromophenyl)sulfonylpiperazin-1-yl]-[4-(2,5-dimethylpyrrol-1-yl)phenyl]methanone Openeye Name: [4-(4-bromophenyl)sulfonylpiperazin-1-yl]-[4-(2,5-dimethylpyrrol-1-yl)phenyl]methanone CAS Name: [4-(4-bromophenyl)sulfonyl-1-piperazinyl]-[4-(2,5-dimethyl-1-pyrrolyl)phenyl]methanone IUPAC Name: [4-(4-bromophenyl)sulfonylpiperazin-1-yl]-[4-(2,5-dimethylpyrrol-1-yl)phenyl]methanone Traditional Name: (4-brosylpiperazino)-[4-(2,5-dimethylpyrrol-1-yl)phenyl]methanone Formula: C23H24BrN3O3S MolecularWeight: 502.42396

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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)Br)C

Isomeric SMILES

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

InChI

InChI=1S/C23H24BrN3O3S/c1-17-3-4-18(2)27(17)21-9-5-19(6-10-21)23(28)25-13-15-26(16-14-25)31(29,30)22-11-7-20(24)8-12-22/h3-12H,13-16H2,1-2H3