3-bromanyl-N-[2-[3-methoxypropyl-[[1-[[3-(trifluoromethyl)phenyl]methyl]pyrrol-2-yl]methyl]amino]-2-oxidanylidene-ethyl]-N-(phenylmethyl)benzamide

Systemtic Name: 3-bromanyl-N-[2-[3-methoxypropyl-[[1-[[3-(trifluoromethyl)phenyl]methyl]pyrrol-2-yl]methyl]amino]-2-oxidanylidene-ethyl]-N-(phenylmethyl)benzamide Openeye Name: N-benzyl-3-bromo-N-[2-[3-methoxypropyl-[[1-[[3-(trifluoromethyl)phenyl]methyl]pyrrol-2-yl]methyl]amino]-2-oxo-ethyl]benzamide CAS Name: 3-bromo-N-[2-[3-methoxypropyl-[[1-[[3-(trifluoromethyl)phenyl]methyl]-2-pyrrolyl]methyl]amino]-2-oxoethyl]-N-(phenylmethyl)benzamide IUPAC Name: N-benzyl-3-bromo-N-[2-[3-methoxypropyl-[[1-[[3-(trifluoromethyl)phenyl]methyl]pyrrol-2-yl]methyl]amino]-2-oxoethyl]benzamide Traditional Name: N-benzyl-3-bromo-N-[2-keto-2-[3-methoxypropyl-[[1-[3-(trifluoromethyl)benzyl]pyrrol-2-yl]methyl]amino]ethyl]benzamide Formula: C33H33BrF3N3O3 MolecularWeight: 656.53263

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Descriptors Computed from Structure

Canonical SMILES:

COCCCN(CC1=CC=CN1CC2=CC(=CC=C2)C(F)(F)F)C(=O)CN(CC3=CC=CC=C3)C(=O)C4=CC(=CC=C4)Br

Isomeric SMILES

COCCCN(CC1=CC=CN1CC2=CC(=CC=C2)C(F)(F)F)C(=O)CN(CC3=CC=CC=C3)C(=O)C4=CC(=CC=C4)Br

InChI

InChI=1S/C33H33BrF3N3O3/c1-43-18-8-17-39(23-30-15-7-16-38(30)22-26-11-5-13-28(19-26)33(35,36)37)31(41)24-40(21-25-9-3-2-4-10-25)32(42)27-12-6-14-29(34)20-27/h2-7,9-16,19-20H,8,17-18,21-24H2,1H3