methyl 3-[2-[[(1S)-1-naphthalen-1-ylethyl]amino]-2-oxidanylidene-ethyl]sulfanylpropanoate

Systemtic Name: methyl 3-[2-[[(1S)-1-naphthalen-1-ylethyl]amino]-2-oxidanylidene-ethyl]sulfanylpropanoate Openeye Name: methyl 3-[2-[[(1S)-1-(1-naphthyl)ethyl]amino]-2-oxo-ethyl]sulfanylpropanoate CAS Name: 3-[[2-[[(1S)-1-(1-naphthalenyl)ethyl]amino]-2-oxoethyl]thio]propanoic acid methyl ester IUPAC Name: methyl 3-[2-[[(1S)-1-naphthalen-1-ylethyl]amino]-2-oxoethyl]sulfanylpropanoate Traditional Name: 3-[[2-keto-2-[[(1S)-1-(1-naphthyl)ethyl]amino]ethyl]thio]propionic acid methyl ester Formula: C18H21NO3S MolecularWeight: 331.42924

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Descriptors Computed from Structure

Canonical SMILES:

CC(C1=CC=CC2=CC=CC=C21)NC(=O)CSCCC(=O)OC

Isomeric SMILES

C[C@@H](C1=CC=CC2=CC=CC=C21)NC(=O)CSCCC(=O)OC

InChI

InChI=1S/C18H21NO3S/c1-13(19-17(20)12-23-11-10-18(21)22-2)15-9-5-7-14-6-3-4-8-16(14)15/h3-9,13H,10-12H2,1-2H3,(H,19,20)/t13-/m0/s1