[2-oxidanylidene-2-[2-(thiophen-2-ylmethylsulfanyl)ethylamino]ethyl] 2-(4-chloranyl-2-methyl-phenoxy)ethanoate

Systemtic Name: [2-oxidanylidene-2-[2-(thiophen-2-ylmethylsulfanyl)ethylamino]ethyl] 2-(4-chloranyl-2-methyl-phenoxy)ethanoate Openeye Name: [2-oxo-2-[2-(2-thienylmethylsulfanyl)ethylamino]ethyl] 2-(4-chloro-2-methyl-phenoxy)acetate CAS Name: 2-(4-chloro-2-methylphenoxy)acetic acid [2-oxo-2-[2-(thiophen-2-ylmethylthio)ethylamino]ethyl] ester IUPAC Name: [2-oxo-2-[2-(thiophen-2-ylmethylsulfanyl)ethylamino]ethyl] 2-(4-chloro-2-methylphenoxy)acetate Traditional Name: 2-(4-chloro-2-methyl-phenoxy)acetic acid [2-keto-2-[2-(2-thenylthio)ethylamino]ethyl] ester Formula: C18H20ClNO4S2 MolecularWeight: 413.9387

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C(C=CC(=C1)Cl)OCC(=O)OCC(=O)NCCSCC2=CC=CS2

Isomeric SMILES

CC1=C(C=CC(=C1)Cl)OCC(=O)OCC(=O)NCCSCC2=CC=CS2

InChI

InChI=1S/C18H20ClNO4S2/c1-13-9-14(19)4-5-16(13)23-11-18(22)24-10-17(21)20-6-8-25-12-15-3-2-7-26-15/h2-5,7,9H,6,8,10-12H2,1H3,(H,20,21)