N-[2-[[1-[(4-bromophenyl)methyl]pyrrol-2-yl]methyl-butyl-amino]-2-oxidanylidene-ethyl]-3-cyclopentyl-N-propan-2-yl-propanamide

Systemtic Name: N-[2-[[1-[(4-bromophenyl)methyl]pyrrol-2-yl]methyl-butyl-amino]-2-oxidanylidene-ethyl]-3-cyclopentyl-N-propan-2-yl-propanamide Openeye Name: N-[2-[[1-[(4-bromophenyl)methyl]pyrrol-2-yl]methyl-butyl-amino]-2-oxo-ethyl]-3-cyclopentyl-N-isopropyl-propanamide CAS Name: N-[2-[[1-[(4-bromophenyl)methyl]-2-pyrrolyl]methyl-butylamino]-2-oxoethyl]-3-cyclopentyl-N-propan-2-ylpropanamide IUPAC Name: N-[2-[[1-[(4-bromophenyl)methyl]pyrrol-2-yl]methyl-butylamino]-2-oxoethyl]-3-cyclopentyl-N-propan-2-ylpropanamide Traditional Name: N-[2-[[1-(4-bromobenzyl)pyrrol-2-yl]methyl-butyl-amino]-2-keto-ethyl]-3-cyclopentyl-N-isopropyl-propionamide Formula: C29H42BrN3O2 MolecularWeight: 544.56668

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Descriptors Computed from Structure

Canonical SMILES:

CCCCN(CC1=CC=CN1CC2=CC=C(C=C2)Br)C(=O)CN(C(C)C)C(=O)CCC3CCCC3

Isomeric SMILES

CCCCN(CC1=CC=CN1CC2=CC=C(C=C2)Br)C(=O)CN(C(C)C)C(=O)CCC3CCCC3

InChI

InChI=1S/C29H42BrN3O2/c1-4-5-18-32(21-27-11-8-19-31(27)20-25-12-15-26(30)16-13-25)29(35)22-33(23(2)3)28(34)17-14-24-9-6-7-10-24/h8,11-13,15-16,19,23-24H,4-7,9-10,14,17-18,20-22H2,1-3H3