N-[2-[[1-[(4-bromophenyl)methyl]pyrrol-2-yl]methyl-cyclohexyl-amino]-2-oxidanylidene-ethyl]-2,2-dimethyl-N-(2-methylpropyl)propanamide

Systemtic Name: N-[2-[[1-[(4-bromophenyl)methyl]pyrrol-2-yl]methyl-cyclohexyl-amino]-2-oxidanylidene-ethyl]-2,2-dimethyl-N-(2-methylpropyl)propanamide Openeye Name: N-[2-[[1-[(4-bromophenyl)methyl]pyrrol-2-yl]methyl-cyclohexyl-amino]-2-oxo-ethyl]-N-isobutyl-2,2-dimethyl-propanamide CAS Name: N-[2-[[1-[(4-bromophenyl)methyl]-2-pyrrolyl]methyl-cyclohexylamino]-2-oxoethyl]-2,2-dimethyl-N-(2-methylpropyl)propanamide IUPAC Name: N-[2-[[1-[(4-bromophenyl)methyl]pyrrol-2-yl]methyl-cyclohexylamino]-2-oxoethyl]-2,2-dimethyl-N-(2-methylpropyl)propanamide Traditional Name: N-[2-[[1-(4-bromobenzyl)pyrrol-2-yl]methyl-cyclohexyl-amino]-2-keto-ethyl]-N-isobutyl-2,2-dimethyl-propionamide Formula: C29H42BrN3O2 MolecularWeight: 544.56668

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)CN(CC(=O)N(CC1=CC=CN1CC2=CC=C(C=C2)Br)C3CCCCC3)C(=O)C(C)(C)C

Isomeric SMILES

CC(C)CN(CC(=O)N(CC1=CC=CN1CC2=CC=C(C=C2)Br)C3CCCCC3)C(=O)C(C)(C)C

InChI

InChI=1S/C29H42BrN3O2/c1-22(2)18-32(28(35)29(3,4)5)21-27(34)33(25-10-7-6-8-11-25)20-26-12-9-17-31(26)19-23-13-15-24(30)16-14-23/h9,12-17,22,25H,6-8,10-11,18-21H2,1-5H3