[2-oxidanylidene-2-(pentan-3-ylamino)ethyl] 2-[2-(1,3-dithiolan-2-yl)phenoxy]ethanoate

Systemtic Name: [2-oxidanylidene-2-(pentan-3-ylamino)ethyl] 2-[2-(1,3-dithiolan-2-yl)phenoxy]ethanoate Openeye Name: [2-(1-ethylpropylamino)-2-oxo-ethyl] 2-[2-(1,3-dithiolan-2-yl)phenoxy]acetate CAS Name: 2-[2-(1,3-dithiolan-2-yl)phenoxy]acetic acid [2-oxo-2-(pentan-3-ylamino)ethyl] ester IUPAC Name: [2-oxo-2-(pentan-3-ylamino)ethyl] 2-[2-(1,3-dithiolan-2-yl)phenoxy]acetate Traditional Name: 2-[2-(1,3-dithiolan-2-yl)phenoxy]acetic acid [2-(1-ethylpropylamino)-2-keto-ethyl] ester Formula: C18H25NO4S2 MolecularWeight: 383.5254

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Descriptors Computed from Structure

Canonical SMILES:

CCC(CC)NC(=O)COC(=O)COC1=CC=CC=C1C2SCCS2

Isomeric SMILES

CCC(CC)NC(=O)COC(=O)COC1=CC=CC=C1C2SCCS2

InChI

InChI=1S/C18H25NO4S2/c1-3-13(4-2)19-16(20)11-23-17(21)12-22-15-8-6-5-7-14(15)18-24-9-10-25-18/h5-8,13,18H,3-4,9-12H2,1-2H3,(H,19,20)