N-tert-butyl-4-[1-(2-fluorophenyl)-5-(3-methoxyphenyl)-2-methyl-pyrrol-3-yl]carbonyl-piperazine-1-carboxamide

Systemtic Name: N-tert-butyl-4-[1-(2-fluorophenyl)-5-(3-methoxyphenyl)-2-methyl-pyrrol-3-yl]carbonyl-piperazine-1-carboxamide Openeye Name: N-tert-butyl-4-[1-(2-fluorophenyl)-5-(3-methoxyphenyl)-2-methyl-pyrrole-3-carbonyl]piperazine-1-carboxamide CAS Name: N-tert-butyl-4-[[1-(2-fluorophenyl)-5-(3-methoxyphenyl)-2-methyl-3-pyrrolyl]-oxomethyl]-1-piperazinecarboxamide IUPAC Name: N-tert-butyl-4-[1-(2-fluorophenyl)-5-(3-methoxyphenyl)-2-methylpyrrole-3-carbonyl]piperazine-1-carboxamide Traditional Name: N-tert-butyl-4-[1-(2-fluorophenyl)-5-(3-methoxyphenyl)-2-methyl-pyrrole-3-carbonyl]piperazine-1-carboxamide Formula: C28H33FN4O3 MolecularWeight: 492.585023

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C28H33FN4O3/c1-19-22(26(34)31-13-15-32(16-14-31)27(35)30-28(2,3)4)18-25(20-9-8-10-21(17-20)36-5)33(19)24-12-7-6-11-23(24)29/h6-12,17-18H,13-16H2,1-5H3,(H,30,35)