1-(4-ethanoyl-3,5-dimethyl-1H-pyrrol-2-yl)-2-[4-(3-fluorophenyl)sulfonylpiperazin-1-yl]ethanone

Systemtic Name: 1-(4-ethanoyl-3,5-dimethyl-1H-pyrrol-2-yl)-2-[4-(3-fluorophenyl)sulfonylpiperazin-1-yl]ethanone Openeye Name: 1-(4-acetyl-3,5-dimethyl-1H-pyrrol-2-yl)-2-[4-(3-fluorophenyl)sulfonylpiperazin-1-yl]ethanone CAS Name: 1-(4-acetyl-3,5-dimethyl-1H-pyrrol-2-yl)-2-[4-(3-fluorophenyl)sulfonyl-1-piperazinyl]ethanone IUPAC Name: 1-(4-acetyl-3,5-dimethyl-1H-pyrrol-2-yl)-2-[4-(3-fluorophenyl)sulfonylpiperazin-1-yl]ethanone Traditional Name: 1-(4-acetyl-3,5-dimethyl-1H-pyrrol-2-yl)-2-[4-(3-fluorophenyl)sulfonylpiperazino]ethanone Formula: C20H24FN3O4S MolecularWeight: 421.485663

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C(NC(=C1C(=O)C)C)C(=O)CN2CCN(CC2)S(=O)(=O)C3=CC=CC(=C3)F

Isomeric SMILES

CC1=C(NC(=C1C(=O)C)C)C(=O)CN2CCN(CC2)S(=O)(=O)C3=CC=CC(=C3)F

InChI

InChI=1S/C20H24FN3O4S/c1-13-19(15(3)25)14(2)22-20(13)18(26)12-23-7-9-24(10-8-23)29(27,28)17-6-4-5-16(21)11-17/h4-6,11,22H,7-10,12H2,1-3H3