ethyl 3-[3-[(3,5-dimethyl-1,2-oxazol-4-yl)sulfonylamino]propanoylamino]benzoate

Systemtic Name: ethyl 3-[3-[(3,5-dimethyl-1,2-oxazol-4-yl)sulfonylamino]propanoylamino]benzoate Openeye Name: ethyl 3-[3-[(3,5-dimethylisoxazol-4-yl)sulfonylamino]propanoylamino]benzoate CAS Name: 3-[[3-[(3,5-dimethyl-4-isoxazolyl)sulfonylamino]-1-oxopropyl]amino]benzoic acid ethyl ester IUPAC Name: ethyl 3-[3-[(3,5-dimethyl-1,2-oxazol-4-yl)sulfonylamino]propanoylamino]benzoate Traditional Name: 3-[3-[(3,5-dimethylisoxazol-4-yl)sulfonylamino]propanoylamino]benzoic acid ethyl ester Formula: C17H21N3O6S MolecularWeight: 395.43014

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Descriptors Computed from Structure

Canonical SMILES:

CCOC(=O)C1=CC(=CC=C1)NC(=O)CCNS(=O)(=O)C2=C(ON=C2C)C

Isomeric SMILES

CCOC(=O)C1=CC(=CC=C1)NC(=O)CCNS(=O)(=O)C2=C(ON=C2C)C

InChI

InChI=1S/C17H21N3O6S/c1-4-25-17(22)13-6-5-7-14(10-13)19-15(21)8-9-18-27(23,24)16-11(2)20-26-12(16)3/h5-7,10,18H,4,8-9H2,1-3H3,(H,19,21)