ethyl 2-[[4-[(5-phenyl-1,2,4-oxadiazol-3-yl)methyl]-1,4-diazepan-1-yl]carbonylamino]benzoate

Systemtic Name: ethyl 2-[[4-[(5-phenyl-1,2,4-oxadiazol-3-yl)methyl]-1,4-diazepan-1-yl]carbonylamino]benzoate Openeye Name: ethyl 2-[[4-[(5-phenyl-1,2,4-oxadiazol-3-yl)methyl]-1,4-diazepane-1-carbonyl]amino]benzoate CAS Name: 2-[[oxo-[4-[(5-phenyl-1,2,4-oxadiazol-3-yl)methyl]-1,4-diazepan-1-yl]methyl]amino]benzoic acid ethyl ester IUPAC Name: ethyl 2-[[4-[(5-phenyl-1,2,4-oxadiazol-3-yl)methyl]-1,4-diazepane-1-carbonyl]amino]benzoate Traditional Name: 2-[[4-[(5-phenyl-1,2,4-oxadiazol-3-yl)methyl]-1,4-diazepane-1-carbonyl]amino]benzoic acid ethyl ester Formula: C24H27N5O4 MolecularWeight: 449.50228

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CCOC(=O)C1=CC=CC=C1NC(=O)N2CCCN(CC2)CC3=NOC(=N3)C4=CC=CC=C4

Isomeric SMILES

CCOC(=O)C1=CC=CC=C1NC(=O)N2CCCN(CC2)CC3=NOC(=N3)C4=CC=CC=C4

InChI

InChI=1S/C24H27N5O4/c1-2-32-23(30)19-11-6-7-12-20(19)25-24(31)29-14-8-13-28(15-16-29)17-21-26-22(33-27-21)18-9-4-3-5-10-18/h3-7,9-12H,2,8,13-17H2,1H3,(H,25,31)