[2-oxidanylidene-2-(prop-2-ynylamino)ethyl] (2R)-2-[(4-bromophenyl)methylsulfanyl]propanoate

Systemtic Name: [2-oxidanylidene-2-(prop-2-ynylamino)ethyl] (2R)-2-[(4-bromophenyl)methylsulfanyl]propanoate Openeye Name: [2-oxo-2-(prop-2-ynylamino)ethyl] (2R)-2-[(4-bromophenyl)methylsulfanyl]propanoate CAS Name: (2R)-2-[(4-bromophenyl)methylthio]propanoic acid [2-oxo-2-(prop-2-ynylamino)ethyl] ester IUPAC Name: [2-oxo-2-(prop-2-ynylamino)ethyl] (2R)-2-[(4-bromophenyl)methylsulfanyl]propanoate Traditional Name: (2R)-2-[(4-bromobenzyl)thio]propionic acid [2-keto-2-(propargylamino)ethyl] ester Formula: C15H16BrNO3S MolecularWeight: 370.26144

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Descriptors Computed from Structure

Canonical SMILES:

CC(C(=O)OCC(=O)NCC#C)SCC1=CC=C(C=C1)Br

Isomeric SMILES

C[C@H](C(=O)OCC(=O)NCC#C)SCC1=CC=C(C=C1)Br

InChI

InChI=1S/C15H16BrNO3S/c1-3-8-17-14(18)9-20-15(19)11(2)21-10-12-4-6-13(16)7-5-12/h1,4-7,11H,8-10H2,2H3,(H,17,18)/t11-/m1/s1