ethyl 2-[1-[(4-methyl-3-morpholin-4-ylsulfonyl-phenyl)amino]-1-oxidanylidene-propan-2-yl]sulfanylethanoate

Systemtic Name: ethyl 2-[1-[(4-methyl-3-morpholin-4-ylsulfonyl-phenyl)amino]-1-oxidanylidene-propan-2-yl]sulfanylethanoate Openeye Name: ethyl 2-[1-methyl-2-(4-methyl-3-morpholinosulfonyl-anilino)-2-oxo-ethyl]sulfanylacetate CAS Name: 2-[[1-[4-methyl-3-(4-morpholinylsulfonyl)anilino]-1-oxopropan-2-yl]thio]acetic acid ethyl ester IUPAC Name: ethyl 2-[1-(4-methyl-3-morpholin-4-ylsulfonylanilino)-1-oxopropan-2-yl]sulfanylacetate Traditional Name: 2-[[2-keto-1-methyl-2-(4-methyl-3-morpholinosulfonyl-anilino)ethyl]thio]acetic acid ethyl ester Formula: C18H26N2O6S2 MolecularWeight: 430.53884

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Descriptors Computed from Structure

Canonical SMILES:

CCOC(=O)CSC(C)C(=O)NC1=CC(=C(C=C1)C)S(=O)(=O)N2CCOCC2

Isomeric SMILES

CCOC(=O)CSC(C)C(=O)NC1=CC(=C(C=C1)C)S(=O)(=O)N2CCOCC2

InChI

InChI=1S/C18H26N2O6S2/c1-4-26-17(21)12-27-14(3)18(22)19-15-6-5-13(2)16(11-15)28(23,24)20-7-9-25-10-8-20/h5-6,11,14H,4,7-10,12H2,1-3H3,(H,19,22)