[(2R)-1-oxidanylidene-1-(prop-2-enylamino)propan-2-yl] 2-(2,3-dihydro-1H-inden-5-ylsulfanyl)ethanoate

Systemtic Name: [(2R)-1-oxidanylidene-1-(prop-2-enylamino)propan-2-yl] 2-(2,3-dihydro-1H-inden-5-ylsulfanyl)ethanoate Openeye Name: [(1R)-2-(allylamino)-1-methyl-2-oxo-ethyl] 2-indan-5-ylsulfanylacetate CAS Name: 2-(2,3-dihydro-1H-inden-5-ylthio)acetic acid [(2R)-1-oxo-1-(prop-2-enylamino)propan-2-yl] ester IUPAC Name: [(2R)-1-oxo-1-(prop-2-enylamino)propan-2-yl] 2-(2,3-dihydro-1H-inden-5-ylsulfanyl)acetate Traditional Name: 2-(indan-5-ylthio)acetic acid [(1R)-2-(allylamino)-2-keto-1-methyl-ethyl] ester Formula: C17H21NO3S MolecularWeight: 319.41854

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Descriptors Computed from Structure

Canonical SMILES:

CC(C(=O)NCC=C)OC(=O)CSC1=CC2=C(CCC2)C=C1

Isomeric SMILES

C[C@H](C(=O)NCC=C)OC(=O)CSC1=CC2=C(CCC2)C=C1

InChI

InChI=1S/C17H21NO3S/c1-3-9-18-17(20)12(2)21-16(19)11-22-15-8-7-13-5-4-6-14(13)10-15/h3,7-8,10,12H,1,4-6,9,11H2,2H3,(H,18,20)/t12-/m1/s1