[(2R)-1-oxidanylidene-1-[[(2R)-4-phenylbutan-2-yl]amino]propan-2-yl] 2-(2-methylphenyl)sulfanylethanoate

Systemtic Name: [(2R)-1-oxidanylidene-1-[[(2R)-4-phenylbutan-2-yl]amino]propan-2-yl] 2-(2-methylphenyl)sulfanylethanoate Openeye Name: [(1R)-1-methyl-2-[[(1R)-1-methyl-3-phenyl-propyl]amino]-2-oxo-ethyl] 2-(o-tolylsulfanyl)acetate CAS Name: 2-[(2-methylphenyl)thio]acetic acid [(2R)-1-oxo-1-[[(2R)-4-phenylbutan-2-yl]amino]propan-2-yl] ester IUPAC Name: [(2R)-1-oxo-1-[[(2R)-4-phenylbutan-2-yl]amino]propan-2-yl] 2-(2-methylphenyl)sulfanylacetate Traditional Name: 2-(o-tolylthio)acetic acid [(1R)-2-keto-1-methyl-2-[[(1R)-1-methyl-3-phenyl-propyl]amino]ethyl] ester Formula: C22H27NO3S MolecularWeight: 385.51968

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC=CC=C1SCC(=O)OC(C)C(=O)NC(C)CCC2=CC=CC=C2

Isomeric SMILES

CC1=CC=CC=C1SCC(=O)O[C@H](C)C(=O)N[C@H](C)CCC2=CC=CC=C2

InChI

InChI=1S/C22H27NO3S/c1-16-9-7-8-12-20(16)27-15-21(24)26-18(3)22(25)23-17(2)13-14-19-10-5-4-6-11-19/h4-12,17-18H,13-15H2,1-3H3,(H,23,25)/t17-,18-/m1/s1