1-[4-[5-(4-fluorophenyl)-2-methyl-1-phenyl-pyrrol-3-yl]carbonylpiperazin-1-yl]-3,3-dimethyl-butan-1-one

Systemtic Name: 1-[4-[5-(4-fluorophenyl)-2-methyl-1-phenyl-pyrrol-3-yl]carbonylpiperazin-1-yl]-3,3-dimethyl-butan-1-one Openeye Name: 1-[4-[5-(4-fluorophenyl)-2-methyl-1-phenyl-pyrrole-3-carbonyl]piperazin-1-yl]-3,3-dimethyl-butan-1-one CAS Name: 1-[4-[[5-(4-fluorophenyl)-2-methyl-1-phenyl-3-pyrrolyl]-oxomethyl]-1-piperazinyl]-3,3-dimethyl-1-butanone IUPAC Name: 1-[4-[5-(4-fluorophenyl)-2-methyl-1-phenylpyrrole-3-carbonyl]piperazin-1-yl]-3,3-dimethylbutan-1-one Traditional Name: 1-[4-[5-(4-fluorophenyl)-2-methyl-1-phenyl-pyrrole-3-carbonyl]piperazino]-3,3-dimethyl-butan-1-one Formula: C28H32FN3O2 MolecularWeight: 461.570983

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C(C=C(N1C2=CC=CC=C2)C3=CC=C(C=C3)F)C(=O)N4CCN(CC4)C(=O)CC(C)(C)C

Isomeric SMILES

CC1=C(C=C(N1C2=CC=CC=C2)C3=CC=C(C=C3)F)C(=O)N4CCN(CC4)C(=O)CC(C)(C)C

InChI

InChI=1S/C28H32FN3O2/c1-20-24(27(34)31-16-14-30(15-17-31)26(33)19-28(2,3)4)18-25(21-10-12-22(29)13-11-21)32(20)23-8-6-5-7-9-23/h5-13,18H,14-17,19H2,1-4H3