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

Systemtic Name: (2-oxidanylidene-2-phenylazanyl-ethyl) 2-[(3,5-dimethyl-1,2-oxazol-4-yl)methylsulfanyl]ethanoate Openeye Name: (2-anilino-2-oxo-ethyl) 2-[(3,5-dimethylisoxazol-4-yl)methylsulfanyl]acetate CAS Name: 2-[(3,5-dimethyl-4-isoxazolyl)methylthio]acetic acid (2-anilino-2-oxoethyl) ester IUPAC Name: (2-anilino-2-oxoethyl) 2-[(3,5-dimethyl-1,2-oxazol-4-yl)methylsulfanyl]acetate Traditional Name: 2-[(3,5-dimethylisoxazol-4-yl)methylthio]acetic acid (2-anilino-2-keto-ethyl) ester Formula: C16H18N2O4S MolecularWeight: 334.39012

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C(C(=NO1)C)CSCC(=O)OCC(=O)NC2=CC=CC=C2

Isomeric SMILES

CC1=C(C(=NO1)C)CSCC(=O)OCC(=O)NC2=CC=CC=C2

InChI

InChI=1S/C16H18N2O4S/c1-11-14(12(2)22-18-11)9-23-10-16(20)21-8-15(19)17-13-6-4-3-5-7-13/h3-7H,8-10H2,1-2H3,(H,17,19)