ethyl 2-[2-[(2-chloranyl-5-morpholin-4-ylsulfonyl-phenyl)amino]-2-oxidanylidene-ethyl]sulfanylethanoate

Systemtic Name: ethyl 2-[2-[(2-chloranyl-5-morpholin-4-ylsulfonyl-phenyl)amino]-2-oxidanylidene-ethyl]sulfanylethanoate Openeye Name: ethyl 2-[2-(2-chloro-5-morpholinosulfonyl-anilino)-2-oxo-ethyl]sulfanylacetate CAS Name: 2-[[2-[2-chloro-5-(4-morpholinylsulfonyl)anilino]-2-oxoethyl]thio]acetic acid ethyl ester IUPAC Name: ethyl 2-[2-(2-chloro-5-morpholin-4-ylsulfonylanilino)-2-oxoethyl]sulfanylacetate Traditional Name: 2-[[2-(2-chloro-5-morpholinosulfonyl-anilino)-2-keto-ethyl]thio]acetic acid ethyl ester Formula: C16H21ClN2O6S2 MolecularWeight: 436.93074

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Descriptors Computed from Structure

Canonical SMILES:

CCOC(=O)CSCC(=O)NC1=C(C=CC(=C1)S(=O)(=O)N2CCOCC2)Cl

Isomeric SMILES

CCOC(=O)CSCC(=O)NC1=C(C=CC(=C1)S(=O)(=O)N2CCOCC2)Cl

InChI

InChI=1S/C16H21ClN2O6S2/c1-2-25-16(21)11-26-10-15(20)18-14-9-12(3-4-13(14)17)27(22,23)19-5-7-24-8-6-19/h3-4,9H,2,5-8,10-11H2,1H3,(H,18,20)