(5-fluoranyl-2-pyrrol-1-yl-phenyl)-[4-(4-methoxyphenyl)sulfonylpiperazin-1-yl]methanone

Systemtic Name: (5-fluoranyl-2-pyrrol-1-yl-phenyl)-[4-(4-methoxyphenyl)sulfonylpiperazin-1-yl]methanone Openeye Name: (5-fluoro-2-pyrrol-1-yl-phenyl)-[4-(4-methoxyphenyl)sulfonylpiperazin-1-yl]methanone CAS Name: [5-fluoro-2-(1-pyrrolyl)phenyl]-[4-(4-methoxyphenyl)sulfonyl-1-piperazinyl]methanone IUPAC Name: (5-fluoro-2-pyrrol-1-ylphenyl)-[4-(4-methoxyphenyl)sulfonylpiperazin-1-yl]methanone Traditional Name: (5-fluoro-2-pyrrol-1-yl-phenyl)-[4-(4-methoxyphenyl)sulfonylpiperazino]methanone Formula: C22H22FN3O4S MolecularWeight: 443.491183

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Descriptors Computed from Structure

Canonical SMILES:

COC1=CC=C(C=C1)S(=O)(=O)N2CCN(CC2)C(=O)C3=C(C=CC(=C3)F)N4C=CC=C4

Isomeric SMILES

COC1=CC=C(C=C1)S(=O)(=O)N2CCN(CC2)C(=O)C3=C(C=CC(=C3)F)N4C=CC=C4

InChI

InChI=1S/C22H22FN3O4S/c1-30-18-5-7-19(8-6-18)31(28,29)26-14-12-25(13-15-26)22(27)20-16-17(23)4-9-21(20)24-10-2-3-11-24/h2-11,16H,12-15H2,1H3