[(2S)-1-(naphthalen-2-ylamino)-1-oxidanylidene-propan-2-yl] 2-quinoxalin-2-ylsulfanylethanoate

Systemtic Name: [(2S)-1-(naphthalen-2-ylamino)-1-oxidanylidene-propan-2-yl] 2-quinoxalin-2-ylsulfanylethanoate Openeye Name: [(1S)-1-methyl-2-(2-naphthylamino)-2-oxo-ethyl] 2-quinoxalin-2-ylsulfanylacetate CAS Name: 2-(2-quinoxalinylthio)acetic acid [(2S)-1-(2-naphthalenylamino)-1-oxopropan-2-yl] ester IUPAC Name: [(2S)-1-(naphthalen-2-ylamino)-1-oxopropan-2-yl] 2-quinoxalin-2-ylsulfanylacetate Traditional Name: 2-(quinoxalin-2-ylthio)acetic acid [(1S)-2-keto-1-methyl-2-(2-naphthylamino)ethyl] ester Formula: C23H19N3O3S MolecularWeight: 417.48026

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Descriptors Computed from Structure

Canonical SMILES:

CC(C(=O)NC1=CC2=CC=CC=C2C=C1)OC(=O)CSC3=NC4=CC=CC=C4N=C3

Isomeric SMILES

C[C@@H](C(=O)NC1=CC2=CC=CC=C2C=C1)OC(=O)CSC3=NC4=CC=CC=C4N=C3

InChI

InChI=1S/C23H19N3O3S/c1-15(23(28)25-18-11-10-16-6-2-3-7-17(16)12-18)29-22(27)14-30-21-13-24-19-8-4-5-9-20(19)26-21/h2-13,15H,14H2,1H3,(H,25,28)/t15-/m0/s1