2-[[4-[(1,5-dimethyl-3-oxidanylidene-2-phenyl-pyrazol-4-yl)methyl]-2-oxidanylidene-1-phenethyl-1,4-diazepan-6-yl]oxy]-N,N-diethyl-ethanamide

Systemtic Name: 2-[[4-[(1,5-dimethyl-3-oxidanylidene-2-phenyl-pyrazol-4-yl)methyl]-2-oxidanylidene-1-phenethyl-1,4-diazepan-6-yl]oxy]-N,N-diethyl-ethanamide Openeye Name: 2-[[4-[(1,5-dimethyl-3-oxo-2-phenyl-pyrazol-4-yl)methyl]-2-oxo-1-phenethyl-1,4-diazepan-6-yl]oxy]-N,N-diethyl-acetamide CAS Name: 2-[[4-[(1,5-dimethyl-3-oxo-2-phenyl-4-pyrazolyl)methyl]-2-oxo-1-phenethyl-1,4-diazepan-6-yl]oxy]-N,N-diethylacetamide IUPAC Name: 2-[[4-[(1,5-dimethyl-3-oxo-2-phenylpyrazol-4-yl)methyl]-2-oxo-1-phenethyl-1,4-diazepan-6-yl]oxy]-N,N-diethylacetamide Traditional Name: N,N-diethyl-2-[[2-keto-4-[(3-keto-1,5-dimethyl-2-phenyl-3-pyrazolin-4-yl)methyl]-1-phenethyl-1,4-diazepan-6-yl]oxy]acetamide Formula: C31H41N5O4 MolecularWeight: 547.68834

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Descriptors Computed from Structure

Canonical SMILES:

CCN(CC)C(=O)COC1CN(CC(=O)N(C1)CCC2=CC=CC=C2)CC3=C(N(N(C3=O)C4=CC=CC=C4)C)C

Isomeric SMILES

CCN(CC)C(=O)COC1CN(CC(=O)N(C1)CCC2=CC=CC=C2)CC3=C(N(N(C3=O)C4=CC=CC=C4)C)C

InChI

InChI=1S/C31H41N5O4/c1-5-34(6-2)30(38)23-40-27-19-33(22-29(37)35(20-27)18-17-25-13-9-7-10-14-25)21-28-24(3)32(4)36(31(28)39)26-15-11-8-12-16-26/h7-16,27H,5-6,17-23H2,1-4H3