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

Systemtic Name: N-[2-[[1-[(4-bromophenyl)methyl]pyrrol-2-yl]methyl-cyclohexyl-amino]-2-oxidanylidene-ethyl]-N-propyl-butanamide Openeye Name: N-[2-[[1-[(4-bromophenyl)methyl]pyrrol-2-yl]methyl-cyclohexyl-amino]-2-oxo-ethyl]-N-propyl-butanamide CAS Name: N-[2-[[1-[(4-bromophenyl)methyl]-2-pyrrolyl]methyl-cyclohexylamino]-2-oxoethyl]-N-propylbutanamide IUPAC Name: N-[2-[[1-[(4-bromophenyl)methyl]pyrrol-2-yl]methyl-cyclohexylamino]-2-oxoethyl]-N-propylbutanamide Traditional Name: N-[2-[[1-(4-bromobenzyl)pyrrol-2-yl]methyl-cyclohexyl-amino]-2-keto-ethyl]-N-propyl-butyramide Formula: C27H38BrN3O2 MolecularWeight: 516.51352

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C27H38BrN3O2/c1-3-9-26(32)30(17-4-2)21-27(33)31(24-10-6-5-7-11-24)20-25-12-8-18-29(25)19-22-13-15-23(28)16-14-22/h8,12-16,18,24H,3-7,9-11,17,19-21H2,1-2H3