(E)-N-[2-[[1-[(4-bromophenyl)methyl]pyrrol-2-yl]methyl-butyl-amino]-2-oxidanylidene-ethyl]-N-pentyl-3-phenyl-prop-2-enamide

Systemtic Name: (E)-N-[2-[[1-[(4-bromophenyl)methyl]pyrrol-2-yl]methyl-butyl-amino]-2-oxidanylidene-ethyl]-N-pentyl-3-phenyl-prop-2-enamide Openeye Name: (E)-N-[2-[[1-[(4-bromophenyl)methyl]pyrrol-2-yl]methyl-butyl-amino]-2-oxo-ethyl]-N-pentyl-3-phenyl-prop-2-enamide CAS Name: (E)-N-[2-[[1-[(4-bromophenyl)methyl]-2-pyrrolyl]methyl-butylamino]-2-oxoethyl]-N-pentyl-3-phenyl-2-propenamide IUPAC Name: (E)-N-[2-[[1-[(4-bromophenyl)methyl]pyrrol-2-yl]methyl-butylamino]-2-oxoethyl]-N-pentyl-3-phenylprop-2-enamide Traditional Name: (E)-N-amyl-N-[2-[[1-(4-bromobenzyl)pyrrol-2-yl]methyl-butyl-amino]-2-keto-ethyl]-3-phenyl-acrylamide Formula: C32H40BrN3O2 MolecularWeight: 578.5829

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CCCCCN(CC(=O)N(CCCC)CC1=CC=CN1CC2=CC=C(C=C2)Br)C(=O)C=CC3=CC=CC=C3

Isomeric SMILES

CCCCCN(CC(=O)N(CCCC)CC1=CC=CN1CC2=CC=C(C=C2)Br)C(=O)/C=C/C3=CC=CC=C3

InChI

InChI=1S/C32H40BrN3O2/c1-3-5-10-22-36(31(37)20-17-27-12-8-7-9-13-27)26-32(38)35(21-6-4-2)25-30-14-11-23-34(30)24-28-15-18-29(33)19-16-28/h7-9,11-20,23H,3-6,10,21-22,24-26H2,1-2H3/b20-17+