[2-oxidanylidene-2-(propylamino)ethyl] 2-[(3,5-dimethyl-1,2-oxazol-4-yl)methylsulfanyl]benzoate

Systemtic Name: [2-oxidanylidene-2-(propylamino)ethyl] 2-[(3,5-dimethyl-1,2-oxazol-4-yl)methylsulfanyl]benzoate Openeye Name: [2-oxo-2-(propylamino)ethyl] 2-[(3,5-dimethylisoxazol-4-yl)methylsulfanyl]benzoate CAS Name: 2-[(3,5-dimethyl-4-isoxazolyl)methylthio]benzoic acid [2-oxo-2-(propylamino)ethyl] ester IUPAC Name: [2-oxo-2-(propylamino)ethyl] 2-[(3,5-dimethyl-1,2-oxazol-4-yl)methylsulfanyl]benzoate Traditional Name: 2-[(3,5-dimethylisoxazol-4-yl)methylthio]benzoic acid [2-keto-2-(propylamino)ethyl] ester Formula: C18H22N2O4S MolecularWeight: 362.44328

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Descriptors Computed from Structure

Canonical SMILES:

CCCNC(=O)COC(=O)C1=CC=CC=C1SCC2=C(ON=C2C)C

Isomeric SMILES

CCCNC(=O)COC(=O)C1=CC=CC=C1SCC2=C(ON=C2C)C

InChI

InChI=1S/C18H22N2O4S/c1-4-9-19-17(21)10-23-18(22)14-7-5-6-8-16(14)25-11-15-12(2)20-24-13(15)3/h5-8H,4,9-11H2,1-3H3,(H,19,21)