1-[2,5-dimethyl-1-(phenylsulfonyl)pyrrol-3-yl]sulfonyl-4-(phenylmethyl)piperazine

Systemtic Name: 1-[2,5-dimethyl-1-(phenylsulfonyl)pyrrol-3-yl]sulfonyl-4-(phenylmethyl)piperazine Openeye Name: 1-[1-(benzenesulfonyl)-2,5-dimethyl-pyrrol-3-yl]sulfonyl-4-benzyl-piperazine CAS Name: 1-[[1-(benzenesulfonyl)-2,5-dimethyl-3-pyrrolyl]sulfonyl]-4-(phenylmethyl)piperazine IUPAC Name: 1-[1-(benzenesulfonyl)-2,5-dimethylpyrrol-3-yl]sulfonyl-4-benzylpiperazine Traditional Name: 1-benzyl-4-(1-besyl-2,5-dimethyl-pyrrol-3-yl)sulfonyl-piperazine Formula: C23H27N3O4S2 MolecularWeight: 473.60818

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC(=C(N1S(=O)(=O)C2=CC=CC=C2)C)S(=O)(=O)N3CCN(CC3)CC4=CC=CC=C4

Isomeric SMILES

CC1=CC(=C(N1S(=O)(=O)C2=CC=CC=C2)C)S(=O)(=O)N3CCN(CC3)CC4=CC=CC=C4

InChI

InChI=1S/C23H27N3O4S2/c1-19-17-23(20(2)26(19)31(27,28)22-11-7-4-8-12-22)32(29,30)25-15-13-24(14-16-25)18-21-9-5-3-6-10-21/h3-12,17H,13-16,18H2,1-2H3