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

Systemtic Name: [2-oxidanylidene-2-(3-phenylsulfanylpropylamino)ethyl] 2-[(3,5-dimethyl-1,2-oxazol-4-yl)methylsulfanyl]ethanoate Openeye Name: [2-oxo-2-(3-phenylsulfanylpropylamino)ethyl] 2-[(3,5-dimethylisoxazol-4-yl)methylsulfanyl]acetate CAS Name: 2-[(3,5-dimethyl-4-isoxazolyl)methylthio]acetic acid [2-oxo-2-[3-(phenylthio)propylamino]ethyl] ester IUPAC Name: [2-oxo-2-(3-phenylsulfanylpropylamino)ethyl] 2-[(3,5-dimethyl-1,2-oxazol-4-yl)methylsulfanyl]acetate Traditional Name: 2-[(3,5-dimethylisoxazol-4-yl)methylthio]acetic acid [2-keto-2-[3-(phenylthio)propylamino]ethyl] ester Formula: C19H24N2O4S2 MolecularWeight: 408.53486

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C(C(=NO1)C)CSCC(=O)OCC(=O)NCCCSC2=CC=CC=C2

Isomeric SMILES

CC1=C(C(=NO1)C)CSCC(=O)OCC(=O)NCCCSC2=CC=CC=C2

InChI

InChI=1S/C19H24N2O4S2/c1-14-17(15(2)25-21-14)12-26-13-19(23)24-11-18(22)20-9-6-10-27-16-7-4-3-5-8-16/h3-5,7-8H,6,9-13H2,1-2H3,(H,20,22)