N-[2-[[1-[(4-bromophenyl)methyl]pyrrol-2-yl]methyl-butyl-amino]-2-oxidanylidene-ethyl]-3-fluoranyl-N-propan-2-yl-benzamide

Systemtic Name: N-[2-[[1-[(4-bromophenyl)methyl]pyrrol-2-yl]methyl-butyl-amino]-2-oxidanylidene-ethyl]-3-fluoranyl-N-propan-2-yl-benzamide Openeye Name: N-[2-[[1-[(4-bromophenyl)methyl]pyrrol-2-yl]methyl-butyl-amino]-2-oxo-ethyl]-3-fluoro-N-isopropyl-benzamide CAS Name: N-[2-[[1-[(4-bromophenyl)methyl]-2-pyrrolyl]methyl-butylamino]-2-oxoethyl]-3-fluoro-N-propan-2-ylbenzamide IUPAC Name: N-[2-[[1-[(4-bromophenyl)methyl]pyrrol-2-yl]methyl-butylamino]-2-oxoethyl]-3-fluoro-N-propan-2-ylbenzamide Traditional Name: N-[2-[[1-(4-bromobenzyl)pyrrol-2-yl]methyl-butyl-amino]-2-keto-ethyl]-3-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=C3)F

Isomeric SMILES

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

InChI

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