N,N-diethyl-2-[[2-oxidanylidene-1-phenethyl-4-[(1-pyrimidin-2-ylpyrrol-2-yl)methyl]-1,4-diazepan-6-yl]oxy]ethanamide

Systemtic Name: N,N-diethyl-2-[[2-oxidanylidene-1-phenethyl-4-[(1-pyrimidin-2-ylpyrrol-2-yl)methyl]-1,4-diazepan-6-yl]oxy]ethanamide Openeye Name: N,N-diethyl-2-[[2-oxo-1-phenethyl-4-[(1-pyrimidin-2-ylpyrrol-2-yl)methyl]-1,4-diazepan-6-yl]oxy]acetamide CAS Name: N,N-diethyl-2-[[2-oxo-1-phenethyl-4-[[1-(2-pyrimidinyl)-2-pyrrolyl]methyl]-1,4-diazepan-6-yl]oxy]acetamide IUPAC Name: N,N-diethyl-2-[[2-oxo-1-phenethyl-4-[(1-pyrimidin-2-ylpyrrol-2-yl)methyl]-1,4-diazepan-6-yl]oxy]acetamide Traditional Name: N,N-diethyl-2-[[2-keto-1-phenethyl-4-[[1-(2-pyrimidyl)pyrrol-2-yl]methyl]-1,4-diazepan-6-yl]oxy]acetamide Formula: C28H36N6O3 MolecularWeight: 504.62384

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Descriptors Computed from Structure

Canonical SMILES:

CCN(CC)C(=O)COC1CN(CC(=O)N(C1)CCC2=CC=CC=C2)CC3=CC=CN3C4=NC=CC=N4

Isomeric SMILES

CCN(CC)C(=O)COC1CN(CC(=O)N(C1)CCC2=CC=CC=C2)CC3=CC=CN3C4=NC=CC=N4

InChI

InChI=1S/C28H36N6O3/c1-3-32(4-2)27(36)22-37-25-19-31(18-24-12-8-16-34(24)28-29-14-9-15-30-28)21-26(35)33(20-25)17-13-23-10-6-5-7-11-23/h5-12,14-16,25H,3-4,13,17-22H2,1-2H3