[2-[[(2R)-butan-2-yl]amino]-2-oxidanylidene-ethyl] 2-(4-bromophenyl)sulfanylethanoate

Systemtic Name: [2-[[(2R)-butan-2-yl]amino]-2-oxidanylidene-ethyl] 2-(4-bromophenyl)sulfanylethanoate Openeye Name: [2-[[(1R)-1-methylpropyl]amino]-2-oxo-ethyl] 2-(4-bromophenyl)sulfanylacetate CAS Name: 2-[(4-bromophenyl)thio]acetic acid [2-[[(2R)-butan-2-yl]amino]-2-oxoethyl] ester IUPAC Name: [2-[[(2R)-butan-2-yl]amino]-2-oxoethyl] 2-(4-bromophenyl)sulfanylacetate Traditional Name: 2-[(4-bromophenyl)thio]acetic acid [2-keto-2-[[(1R)-1-methylpropyl]amino]ethyl] ester Formula: C14H18BrNO3S MolecularWeight: 360.26662

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CCC(C)NC(=O)COC(=O)CSC1=CC=C(C=C1)Br

Isomeric SMILES

CC[C@@H](C)NC(=O)COC(=O)CSC1=CC=C(C=C1)Br

InChI

InChI=1S/C14H18BrNO3S/c1-3-10(2)16-13(17)8-19-14(18)9-20-12-6-4-11(15)5-7-12/h4-7,10H,3,8-9H2,1-2H3,(H,16,17)/t10-/m1/s1