N-[2-[[1-[(4-bromophenyl)methyl]pyrrol-2-yl]methyl-butyl-amino]-2-oxidanylidene-ethyl]-2-fluoranyl-N-propan-2-yl-benzamide

Systemtic Name: N-[2-[[1-[(4-bromophenyl)methyl]pyrrol-2-yl]methyl-butyl-amino]-2-oxidanylidene-ethyl]-2-fluoranyl-N-propan-2-yl-benzamide Openeye Name: N-[2-[[1-[(4-bromophenyl)methyl]pyrrol-2-yl]methyl-butyl-amino]-2-oxo-ethyl]-2-fluoro-N-isopropyl-benzamide CAS Name: N-[2-[[1-[(4-bromophenyl)methyl]-2-pyrrolyl]methyl-butylamino]-2-oxoethyl]-2-fluoro-N-propan-2-ylbenzamide IUPAC Name: N-[2-[[1-[(4-bromophenyl)methyl]pyrrol-2-yl]methyl-butylamino]-2-oxoethyl]-2-fluoro-N-propan-2-ylbenzamide Traditional Name: N-[2-[[1-(4-bromobenzyl)pyrrol-2-yl]methyl-butyl-amino]-2-keto-ethyl]-2-fluoro-N-isopropyl-benzamide Formula: C28H33BrFN3O2 MolecularWeight: 542.482923

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Descriptors Computed from Structure

Canonical SMILES:

CCCCN(CC1=CC=CN1CC2=CC=C(C=C2)Br)C(=O)CN(C(C)C)C(=O)C3=CC=CC=C3F

Isomeric SMILES

CCCCN(CC1=CC=CN1CC2=CC=C(C=C2)Br)C(=O)CN(C(C)C)C(=O)C3=CC=CC=C3F

InChI

InChI=1S/C28H33BrFN3O2/c1-4-5-16-32(19-24-9-8-17-31(24)18-22-12-14-23(29)15-13-22)27(34)20-33(21(2)3)28(35)25-10-6-7-11-26(25)30/h6-15,17,21H,4-5,16,18-20H2,1-3H3