[2-[[2-(2-azanyl-2-oxidanylidene-ethyl)sulfanylphenyl]amino]-2-oxidanylidene-ethyl] (2R)-2-phenoxypropanoate

Systemtic Name: [2-[[2-(2-azanyl-2-oxidanylidene-ethyl)sulfanylphenyl]amino]-2-oxidanylidene-ethyl] (2R)-2-phenoxypropanoate Openeye Name: [2-[2-(2-amino-2-oxo-ethyl)sulfanylanilino]-2-oxo-ethyl] (2R)-2-phenoxypropanoate CAS Name: (2R)-2-phenoxypropanoic acid [2-[2-[(2-amino-2-oxoethyl)thio]anilino]-2-oxoethyl] ester IUPAC Name: [2-[2-(2-amino-2-oxoethyl)sulfanylanilino]-2-oxoethyl] (2R)-2-phenoxypropanoate Traditional Name: (2R)-2-phenoxypropionic acid [2-[2-[(2-amino-2-keto-ethyl)thio]anilino]-2-keto-ethyl] ester Formula: C19H20N2O5S MolecularWeight: 388.4375

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Descriptors Computed from Structure

Canonical SMILES:

CC(C(=O)OCC(=O)NC1=CC=CC=C1SCC(=O)N)OC2=CC=CC=C2

Isomeric SMILES

C[C@H](C(=O)OCC(=O)NC1=CC=CC=C1SCC(=O)N)OC2=CC=CC=C2

InChI

InChI=1S/C19H20N2O5S/c1-13(26-14-7-3-2-4-8-14)19(24)25-11-18(23)21-15-9-5-6-10-16(15)27-12-17(20)22/h2-10,13H,11-12H2,1H3,(H2,20,22)(H,21,23)/t13-/m1/s1