1-[2,4-dimethyl-5-[4-(2,4,6-trimethylphenyl)sulfonylpiperazin-1-yl]carbonyl-1H-pyrrol-3-yl]ethanone

Systemtic Name: 1-[2,4-dimethyl-5-[4-(2,4,6-trimethylphenyl)sulfonylpiperazin-1-yl]carbonyl-1H-pyrrol-3-yl]ethanone Openeye Name: 1-[2,4-dimethyl-5-[4-(2,4,6-trimethylphenyl)sulfonylpiperazine-1-carbonyl]-1H-pyrrol-3-yl]ethanone CAS Name: 1-[2,4-dimethyl-5-[oxo-[4-(2,4,6-trimethylphenyl)sulfonyl-1-piperazinyl]methyl]-1H-pyrrol-3-yl]ethanone IUPAC Name: 1-[2,4-dimethyl-5-[4-(2,4,6-trimethylphenyl)sulfonylpiperazine-1-carbonyl]-1H-pyrrol-3-yl]ethanone Traditional Name: 1-[5-(4-mesitylsulfonylpiperazine-1-carbonyl)-2,4-dimethyl-1H-pyrrol-3-yl]ethanone Formula: C22H29N3O4S MolecularWeight: 431.54836

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC(=C(C(=C1)C)S(=O)(=O)N2CCN(CC2)C(=O)C3=C(C(=C(N3)C)C(=O)C)C)C

Isomeric SMILES

CC1=CC(=C(C(=C1)C)S(=O)(=O)N2CCN(CC2)C(=O)C3=C(C(=C(N3)C)C(=O)C)C)C

InChI

InChI=1S/C22H29N3O4S/c1-13-11-14(2)21(15(3)12-13)30(28,29)25-9-7-24(8-10-25)22(27)20-16(4)19(18(6)26)17(5)23-20/h11-12,23H,7-10H2,1-6H3