[2-oxidanylidene-2-(quinolin-5-ylamino)ethyl] (2S)-2-phenylsulfanylpropanoate

Systemtic Name: [2-oxidanylidene-2-(quinolin-5-ylamino)ethyl] (2S)-2-phenylsulfanylpropanoate Openeye Name: [2-oxo-2-(5-quinolylamino)ethyl] (2S)-2-phenylsulfanylpropanoate CAS Name: (2S)-2-(phenylthio)propanoic acid [2-oxo-2-(5-quinolinylamino)ethyl] ester IUPAC Name: [2-oxo-2-(quinolin-5-ylamino)ethyl] (2S)-2-phenylsulfanylpropanoate Traditional Name: (2S)-2-(phenylthio)propionic acid [2-keto-2-(5-quinolylamino)ethyl] ester Formula: C20H18N2O3S MolecularWeight: 366.43352

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Descriptors Computed from Structure

Canonical SMILES:

CC(C(=O)OCC(=O)NC1=CC=CC2=C1C=CC=N2)SC3=CC=CC=C3

Isomeric SMILES

C[C@@H](C(=O)OCC(=O)NC1=CC=CC2=C1C=CC=N2)SC3=CC=CC=C3

InChI

InChI=1S/C20H18N2O3S/c1-14(26-15-7-3-2-4-8-15)20(24)25-13-19(23)22-18-11-5-10-17-16(18)9-6-12-21-17/h2-12,14H,13H2,1H3,(H,22,23)/t14-/m0/s1