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

Systemtic Name: N-[2-[[1-[(4-bromophenyl)methyl]pyrrol-2-yl]methyl-butyl-amino]-2-oxidanylidene-ethyl]-4-fluoranyl-N-propyl-benzamide Openeye Name: N-[2-[[1-[(4-bromophenyl)methyl]pyrrol-2-yl]methyl-butyl-amino]-2-oxo-ethyl]-4-fluoro-N-propyl-benzamide CAS Name: N-[2-[[1-[(4-bromophenyl)methyl]-2-pyrrolyl]methyl-butylamino]-2-oxoethyl]-4-fluoro-N-propylbenzamide IUPAC Name: N-[2-[[1-[(4-bromophenyl)methyl]pyrrol-2-yl]methyl-butylamino]-2-oxoethyl]-4-fluoro-N-propylbenzamide Traditional Name: N-[2-[[1-(4-bromobenzyl)pyrrol-2-yl]methyl-butyl-amino]-2-keto-ethyl]-4-fluoro-N-propyl-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(CCC)C(=O)C3=CC=C(C=C3)F

Isomeric SMILES

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

InChI

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