[2-oxidanylidene-2-(2-phenylsulfanylethylamino)ethyl] (2S)-2-(6-methoxynaphthalen-2-yl)propanoate

Systemtic Name: [2-oxidanylidene-2-(2-phenylsulfanylethylamino)ethyl] (2S)-2-(6-methoxynaphthalen-2-yl)propanoate Openeye Name: [2-oxo-2-(2-phenylsulfanylethylamino)ethyl] (2S)-2-(6-methoxy-2-naphthyl)propanoate CAS Name: (2S)-2-(6-methoxy-2-naphthalenyl)propanoic acid [2-oxo-2-[2-(phenylthio)ethylamino]ethyl] ester IUPAC Name: [2-oxo-2-(2-phenylsulfanylethylamino)ethyl] (2S)-2-(6-methoxynaphthalen-2-yl)propanoate Traditional Name: (2S)-2-(6-methoxy-2-naphthyl)propionic acid [2-keto-2-[2-(phenylthio)ethylamino]ethyl] ester Formula: C24H25NO4S MolecularWeight: 423.5246

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Descriptors Computed from Structure

Canonical SMILES:

CC(C1=CC2=C(C=C1)C=C(C=C2)OC)C(=O)OCC(=O)NCCSC3=CC=CC=C3

Isomeric SMILES

C[C@@H](C1=CC2=C(C=C1)C=C(C=C2)OC)C(=O)OCC(=O)NCCSC3=CC=CC=C3

InChI

InChI=1S/C24H25NO4S/c1-17(18-8-9-20-15-21(28-2)11-10-19(20)14-18)24(27)29-16-23(26)25-12-13-30-22-6-4-3-5-7-22/h3-11,14-15,17H,12-13,16H2,1-2H3,(H,25,26)/t17-/m0/s1