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

Systemtic Name: N-[2-[[1-[(4-bromophenyl)methyl]pyrrol-2-yl]methyl-butyl-amino]-2-oxidanylidene-ethyl]-N-pentyl-propanamide Openeye Name: N-[2-[[1-[(4-bromophenyl)methyl]pyrrol-2-yl]methyl-butyl-amino]-2-oxo-ethyl]-N-pentyl-propanamide CAS Name: N-[2-[[1-[(4-bromophenyl)methyl]-2-pyrrolyl]methyl-butylamino]-2-oxoethyl]-N-pentylpropanamide IUPAC Name: N-[2-[[1-[(4-bromophenyl)methyl]pyrrol-2-yl]methyl-butylamino]-2-oxoethyl]-N-pentylpropanamide Traditional Name: N-amyl-N-[2-[[1-(4-bromobenzyl)pyrrol-2-yl]methyl-butyl-amino]-2-keto-ethyl]propionamide Formula: C26H38BrN3O2 MolecularWeight: 504.50282

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C26H38BrN3O2/c1-4-7-9-17-30(25(31)6-3)21-26(32)29(16-8-5-2)20-24-11-10-18-28(24)19-22-12-14-23(27)15-13-22/h10-15,18H,4-9,16-17,19-21H2,1-3H3