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

Systemtic Name: N-[2-[[1-[(4-bromophenyl)methyl]pyrrol-2-yl]methyl-butyl-amino]-2-oxidanylidene-ethyl]-N-propyl-hexanamide Openeye Name: N-[2-[[1-[(4-bromophenyl)methyl]pyrrol-2-yl]methyl-butyl-amino]-2-oxo-ethyl]-N-propyl-hexanamide CAS Name: N-[2-[[1-[(4-bromophenyl)methyl]-2-pyrrolyl]methyl-butylamino]-2-oxoethyl]-N-propylhexanamide IUPAC Name: N-[2-[[1-[(4-bromophenyl)methyl]pyrrol-2-yl]methyl-butylamino]-2-oxoethyl]-N-propylhexanamide Traditional Name: N-[2-[[1-(4-bromobenzyl)pyrrol-2-yl]methyl-butyl-amino]-2-keto-ethyl]-N-propyl-hexanamide Formula: C27H40BrN3O2 MolecularWeight: 518.5294

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Descriptors Computed from Structure

Canonical SMILES:

CCCCCC(=O)N(CCC)CC(=O)N(CCCC)CC1=CC=CN1CC2=CC=C(C=C2)Br

Isomeric SMILES

CCCCCC(=O)N(CCC)CC(=O)N(CCCC)CC1=CC=CN1CC2=CC=C(C=C2)Br

InChI

InChI=1S/C27H40BrN3O2/c1-4-7-9-12-26(32)30(17-6-3)22-27(33)31(18-8-5-2)21-25-11-10-19-29(25)20-23-13-15-24(28)16-14-23/h10-11,13-16,19H,4-9,12,17-18,20-22H2,1-3H3