[(2S)-1-(naphthalen-1-ylamino)-1-oxidanylidene-propan-2-yl] 2-(4-methoxyphenyl)sulfanylethanoate

Systemtic Name: [(2S)-1-(naphthalen-1-ylamino)-1-oxidanylidene-propan-2-yl] 2-(4-methoxyphenyl)sulfanylethanoate Openeye Name: [(1S)-1-methyl-2-(1-naphthylamino)-2-oxo-ethyl] 2-(4-methoxyphenyl)sulfanylacetate CAS Name: 2-[(4-methoxyphenyl)thio]acetic acid [(2S)-1-(1-naphthalenylamino)-1-oxopropan-2-yl] ester IUPAC Name: [(2S)-1-(naphthalen-1-ylamino)-1-oxopropan-2-yl] 2-(4-methoxyphenyl)sulfanylacetate Traditional Name: 2-[(4-methoxyphenyl)thio]acetic acid [(1S)-2-keto-1-methyl-2-(1-naphthylamino)ethyl] ester Formula: C22H21NO4S MolecularWeight: 395.47144

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Descriptors Computed from Structure

Canonical SMILES:

CC(C(=O)NC1=CC=CC2=CC=CC=C21)OC(=O)CSC3=CC=C(C=C3)OC

Isomeric SMILES

C[C@@H](C(=O)NC1=CC=CC2=CC=CC=C21)OC(=O)CSC3=CC=C(C=C3)OC

InChI

InChI=1S/C22H21NO4S/c1-15(27-21(24)14-28-18-12-10-17(26-2)11-13-18)22(25)23-20-9-5-7-16-6-3-4-8-19(16)20/h3-13,15H,14H2,1-2H3,(H,23,25)/t15-/m0/s1