methyl 2-[2-oxidanylidene-2-[(3-piperidin-1-ylsulfonylphenyl)amino]ethyl]sulfanylethanoate

Systemtic Name: methyl 2-[2-oxidanylidene-2-[(3-piperidin-1-ylsulfonylphenyl)amino]ethyl]sulfanylethanoate Openeye Name: methyl 2-[2-oxo-2-[3-(1-piperidylsulfonyl)anilino]ethyl]sulfanylacetate CAS Name: 2-[[2-oxo-2-[3-(1-piperidinylsulfonyl)anilino]ethyl]thio]acetic acid methyl ester IUPAC Name: methyl 2-[2-oxo-2-(3-piperidin-1-ylsulfonylanilino)ethyl]sulfanylacetate Traditional Name: 2-[[2-keto-2-(3-piperidinosulfonylanilino)ethyl]thio]acetic acid methyl ester Formula: C16H22N2O5S2 MolecularWeight: 386.48628

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Descriptors Computed from Structure

Canonical SMILES:

COC(=O)CSCC(=O)NC1=CC(=CC=C1)S(=O)(=O)N2CCCCC2

Isomeric SMILES

COC(=O)CSCC(=O)NC1=CC(=CC=C1)S(=O)(=O)N2CCCCC2

InChI

InChI=1S/C16H22N2O5S2/c1-23-16(20)12-24-11-15(19)17-13-6-5-7-14(10-13)25(21,22)18-8-3-2-4-9-18/h5-7,10H,2-4,8-9,11-12H2,1H3,(H,17,19)