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

Systemtic Name: [(2R)-1-oxidanylidene-1-[(phenylmethyl)amino]propan-2-yl] 2-(2,3-dihydro-1H-inden-5-ylsulfanyl)ethanoate Openeye Name: [(1R)-2-(benzylamino)-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-[(phenylmethyl)amino]propan-2-yl] ester IUPAC Name: [(2R)-1-(benzylamino)-1-oxopropan-2-yl] 2-(2,3-dihydro-1H-inden-5-ylsulfanyl)acetate Traditional Name: 2-(indan-5-ylthio)acetic acid [(1R)-2-(benzylamino)-2-keto-1-methyl-ethyl] ester Formula: C21H23NO3S MolecularWeight: 369.47722

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Descriptors Computed from Structure

Canonical SMILES:

CC(C(=O)NCC1=CC=CC=C1)OC(=O)CSC2=CC3=C(CCC3)C=C2

Isomeric SMILES

C[C@H](C(=O)NCC1=CC=CC=C1)OC(=O)CSC2=CC3=C(CCC3)C=C2

InChI

InChI=1S/C21H23NO3S/c1-15(21(24)22-13-16-6-3-2-4-7-16)25-20(23)14-26-19-11-10-17-8-5-9-18(17)12-19/h2-4,6-7,10-12,15H,5,8-9,13-14H2,1H3,(H,22,24)/t15-/m1/s1