[(2R)-1-(naphthalen-1-ylamino)-1-oxidanylidene-propan-2-yl] 2-(2-methylphenyl)sulfanylethanoate

Systemtic Name: [(2R)-1-(naphthalen-1-ylamino)-1-oxidanylidene-propan-2-yl] 2-(2-methylphenyl)sulfanylethanoate Openeye Name: [(1R)-1-methyl-2-(1-naphthylamino)-2-oxo-ethyl] 2-(o-tolylsulfanyl)acetate CAS Name: 2-[(2-methylphenyl)thio]acetic acid [(2R)-1-(1-naphthalenylamino)-1-oxopropan-2-yl] ester IUPAC Name: [(2R)-1-(naphthalen-1-ylamino)-1-oxopropan-2-yl] 2-(2-methylphenyl)sulfanylacetate Traditional Name: 2-(o-tolylthio)acetic acid [(1R)-2-keto-1-methyl-2-(1-naphthylamino)ethyl] ester Formula: C22H21NO3S MolecularWeight: 379.47204

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC=CC=C1SCC(=O)OC(C)C(=O)NC2=CC=CC3=CC=CC=C32

Isomeric SMILES

CC1=CC=CC=C1SCC(=O)O[C@H](C)C(=O)NC2=CC=CC3=CC=CC=C32

InChI

InChI=1S/C22H21NO3S/c1-15-8-3-6-13-20(15)27-14-21(24)26-16(2)22(25)23-19-12-7-10-17-9-4-5-11-18(17)19/h3-13,16H,14H2,1-2H3,(H,23,25)/t16-/m1/s1