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

Systemtic Name: methyl 3-[[(4-methyl-1,2,5-oxadiazol-3-yl)carbonylamino]methyl]-5-(2-phenylethanoylamino)benzoate Openeye Name: methyl 3-[[(4-methyl-1,2,5-oxadiazole-3-carbonyl)amino]methyl]-5-[(2-phenylacetyl)amino]benzoate CAS Name: 3-[[[(4-methyl-1,2,5-oxadiazol-3-yl)-oxomethyl]amino]methyl]-5-[(1-oxo-2-phenylethyl)amino]benzoic acid methyl ester IUPAC Name: methyl 3-[[(4-methyl-1,2,5-oxadiazole-3-carbonyl)amino]methyl]-5-[(2-phenylacetyl)amino]benzoate Traditional Name: 3-[[(4-methylfurazan-3-carbonyl)amino]methyl]-5-[(2-phenylacetyl)amino]benzoic acid methyl ester Formula: C21H20N4O5 MolecularWeight: 408.4073

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Descriptors Computed from Structure

Canonical SMILES:

CC1=NON=C1C(=O)NCC2=CC(=CC(=C2)C(=O)OC)NC(=O)CC3=CC=CC=C3

Isomeric SMILES

CC1=NON=C1C(=O)NCC2=CC(=CC(=C2)C(=O)OC)NC(=O)CC3=CC=CC=C3

InChI

InChI=1S/C21H20N4O5/c1-13-19(25-30-24-13)20(27)22-12-15-8-16(21(28)29-2)11-17(9-15)23-18(26)10-14-6-4-3-5-7-14/h3-9,11H,10,12H2,1-2H3,(H,22,27)(H,23,26)