N-[2-[[1-[(4-bromophenyl)methyl]pyrrol-2-yl]methyl-cyclohexyl-amino]-2-oxidanylidene-ethyl]-N-(3-methoxypropyl)cyclopropanecarboxamide

Systemtic Name: N-[2-[[1-[(4-bromophenyl)methyl]pyrrol-2-yl]methyl-cyclohexyl-amino]-2-oxidanylidene-ethyl]-N-(3-methoxypropyl)cyclopropanecarboxamide Openeye Name: N-[2-[[1-[(4-bromophenyl)methyl]pyrrol-2-yl]methyl-cyclohexyl-amino]-2-oxo-ethyl]-N-(3-methoxypropyl)cyclopropanecarboxamide CAS Name: N-[2-[[1-[(4-bromophenyl)methyl]-2-pyrrolyl]methyl-cyclohexylamino]-2-oxoethyl]-N-(3-methoxypropyl)cyclopropanecarboxamide IUPAC Name: N-[2-[[1-[(4-bromophenyl)methyl]pyrrol-2-yl]methyl-cyclohexylamino]-2-oxoethyl]-N-(3-methoxypropyl)cyclopropanecarboxamide Traditional Name: N-[2-[[1-(4-bromobenzyl)pyrrol-2-yl]methyl-cyclohexyl-amino]-2-keto-ethyl]-N-(3-methoxypropyl)cyclopropanecarboxamide Formula: C28H38BrN3O3 MolecularWeight: 544.52362

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Descriptors Computed from Structure

Canonical SMILES:

COCCCN(CC(=O)N(CC1=CC=CN1CC2=CC=C(C=C2)Br)C3CCCCC3)C(=O)C4CC4

Isomeric SMILES

COCCCN(CC(=O)N(CC1=CC=CN1CC2=CC=C(C=C2)Br)C3CCCCC3)C(=O)C4CC4

InChI

InChI=1S/C28H38BrN3O3/c1-35-18-6-17-31(28(34)23-12-13-23)21-27(33)32(25-7-3-2-4-8-25)20-26-9-5-16-30(26)19-22-10-14-24(29)15-11-22/h5,9-11,14-16,23,25H,2-4,6-8,12-13,17-21H2,1H3