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

Systemtic Name: 1-[4-[1-(2-fluorophenyl)-5-(4-methoxyphenyl)-2-methyl-pyrrol-3-yl]carbonylpiperazin-1-yl]-3-methyl-butan-1-one Openeye Name: 1-[4-[1-(2-fluorophenyl)-5-(4-methoxyphenyl)-2-methyl-pyrrole-3-carbonyl]piperazin-1-yl]-3-methyl-butan-1-one CAS Name: 1-[4-[[1-(2-fluorophenyl)-5-(4-methoxyphenyl)-2-methyl-3-pyrrolyl]-oxomethyl]-1-piperazinyl]-3-methyl-1-butanone IUPAC Name: 1-[4-[1-(2-fluorophenyl)-5-(4-methoxyphenyl)-2-methylpyrrole-3-carbonyl]piperazin-1-yl]-3-methylbutan-1-one Traditional Name: 1-[4-[1-(2-fluorophenyl)-5-(4-methoxyphenyl)-2-methyl-pyrrole-3-carbonyl]piperazino]-3-methyl-butan-1-one Formula: C28H32FN3O3 MolecularWeight: 477.570383

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C(C=C(N1C2=CC=CC=C2F)C3=CC=C(C=C3)OC)C(=O)N4CCN(CC4)C(=O)CC(C)C

Isomeric SMILES

CC1=C(C=C(N1C2=CC=CC=C2F)C3=CC=C(C=C3)OC)C(=O)N4CCN(CC4)C(=O)CC(C)C

InChI

InChI=1S/C28H32FN3O3/c1-19(2)17-27(33)30-13-15-31(16-14-30)28(34)23-18-26(21-9-11-22(35-4)12-10-21)32(20(23)3)25-8-6-5-7-24(25)29/h5-12,18-19H,13-17H2,1-4H3