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

Systemtic Name: 1-(2,5-dimethyl-1H-pyrrol-3-yl)-2-[4-(2-fluorophenyl)sulfonylpiperazin-1-yl]ethanone Openeye Name: 1-(2,5-dimethyl-1H-pyrrol-3-yl)-2-[4-(2-fluorophenyl)sulfonylpiperazin-1-yl]ethanone CAS Name: 1-(2,5-dimethyl-1H-pyrrol-3-yl)-2-[4-(2-fluorophenyl)sulfonyl-1-piperazinyl]ethanone IUPAC Name: 1-(2,5-dimethyl-1H-pyrrol-3-yl)-2-[4-(2-fluorophenyl)sulfonylpiperazin-1-yl]ethanone Traditional Name: 1-(2,5-dimethyl-1H-pyrrol-3-yl)-2-[4-(2-fluorophenyl)sulfonylpiperazino]ethanone Formula: C18H22FN3O3S MolecularWeight: 379.448983

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC(=C(N1)C)C(=O)CN2CCN(CC2)S(=O)(=O)C3=CC=CC=C3F

Isomeric SMILES

CC1=CC(=C(N1)C)C(=O)CN2CCN(CC2)S(=O)(=O)C3=CC=CC=C3F

InChI

InChI=1S/C18H22FN3O3S/c1-13-11-15(14(2)20-13)17(23)12-21-7-9-22(10-8-21)26(24,25)18-6-4-3-5-16(18)19/h3-6,11,20H,7-10,12H2,1-2H3