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

Systemtic Name: 1-[4-[5-(4-fluorophenyl)-2-methyl-1-phenyl-pyrrol-3-yl]carbonylpiperazin-1-yl]-3-methyl-butan-1-one Openeye Name: 1-[4-[5-(4-fluorophenyl)-2-methyl-1-phenyl-pyrrole-3-carbonyl]piperazin-1-yl]-3-methyl-butan-1-one CAS Name: 1-[4-[[5-(4-fluorophenyl)-2-methyl-1-phenyl-3-pyrrolyl]-oxomethyl]-1-piperazinyl]-3-methyl-1-butanone IUPAC Name: 1-[4-[5-(4-fluorophenyl)-2-methyl-1-phenylpyrrole-3-carbonyl]piperazin-1-yl]-3-methylbutan-1-one Traditional Name: 1-[4-[5-(4-fluorophenyl)-2-methyl-1-phenyl-pyrrole-3-carbonyl]piperazino]-3-methyl-butan-1-one Formula: C27H30FN3O2 MolecularWeight: 447.544403

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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

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

InChI

InChI=1S/C27H30FN3O2/c1-19(2)17-26(32)29-13-15-30(16-14-29)27(33)24-18-25(21-9-11-22(28)12-10-21)31(20(24)3)23-7-5-4-6-8-23/h4-12,18-19H,13-17H2,1-3H3