[(2S)-1-oxidanylidene-1-(propylamino)propan-2-yl] 2-(4,5-dihydro-1,3-thiazol-2-ylsulfanylmethyl)benzoate

Systemtic Name: [(2S)-1-oxidanylidene-1-(propylamino)propan-2-yl] 2-(4,5-dihydro-1,3-thiazol-2-ylsulfanylmethyl)benzoate Openeye Name: [(1S)-1-methyl-2-oxo-2-(propylamino)ethyl] 2-(4,5-dihydrothiazol-2-ylsulfanylmethyl)benzoate CAS Name: 2-[(4,5-dihydrothiazol-2-ylthio)methyl]benzoic acid [(2S)-1-oxo-1-(propylamino)propan-2-yl] ester IUPAC Name: [(2S)-1-oxo-1-(propylamino)propan-2-yl] 2-(4,5-dihydro-1,3-thiazol-2-ylsulfanylmethyl)benzoate Traditional Name: 2-[(2-thiazolin-2-ylthio)methyl]benzoic acid [(1S)-2-keto-1-methyl-2-(propylamino)ethyl] ester Formula: C17H22N2O3S2 MolecularWeight: 366.49818

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CCCNC(=O)C(C)OC(=O)C1=CC=CC=C1CSC2=NCCS2

Isomeric SMILES

CCCNC(=O)[C@H](C)OC(=O)C1=CC=CC=C1CSC2=NCCS2

InChI

InChI=1S/C17H22N2O3S2/c1-3-8-18-15(20)12(2)22-16(21)14-7-5-4-6-13(14)11-24-17-19-9-10-23-17/h4-7,12H,3,8-11H2,1-2H3,(H,18,20)/t12-/m0/s1