[2-(butan-2-ylamino)-2-oxidanylidene-ethyl] 2-naphthalen-2-ylsulfanylethanoate

Systemtic Name: [2-(butan-2-ylamino)-2-oxidanylidene-ethyl] 2-naphthalen-2-ylsulfanylethanoate Openeye Name: [2-oxo-2-(sec-butylamino)ethyl] 2-(2-naphthylsulfanyl)acetate CAS Name: 2-(2-naphthalenylthio)acetic acid [2-(butan-2-ylamino)-2-oxoethyl] ester IUPAC Name: [2-(butan-2-ylamino)-2-oxoethyl] 2-naphthalen-2-ylsulfanylacetate Traditional Name: 2-(2-naphthylthio)acetic acid [2-keto-2-(sec-butylamino)ethyl] ester Formula: C18H21NO3S MolecularWeight: 331.42924

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Descriptors Computed from Structure

Canonical SMILES:

CCC(C)NC(=O)COC(=O)CSC1=CC2=CC=CC=C2C=C1

Isomeric SMILES

CCC(C)NC(=O)COC(=O)CSC1=CC2=CC=CC=C2C=C1

InChI

InChI=1S/C18H21NO3S/c1-3-13(2)19-17(20)11-22-18(21)12-23-16-9-8-14-6-4-5-7-15(14)10-16/h4-10,13H,3,11-12H2,1-2H3,(H,19,20)