ethyl 2-[2-[(4-chloranyl-3-piperidin-1-ylsulfonyl-phenyl)amino]-2-oxidanylidene-ethyl]sulfanylethanoate

Systemtic Name: ethyl 2-[2-[(4-chloranyl-3-piperidin-1-ylsulfonyl-phenyl)amino]-2-oxidanylidene-ethyl]sulfanylethanoate Openeye Name: ethyl 2-[2-[4-chloro-3-(1-piperidylsulfonyl)anilino]-2-oxo-ethyl]sulfanylacetate CAS Name: 2-[[2-[4-chloro-3-(1-piperidinylsulfonyl)anilino]-2-oxoethyl]thio]acetic acid ethyl ester IUPAC Name: ethyl 2-[2-(4-chloro-3-piperidin-1-ylsulfonylanilino)-2-oxoethyl]sulfanylacetate Traditional Name: 2-[[2-(4-chloro-3-piperidinosulfonyl-anilino)-2-keto-ethyl]thio]acetic acid ethyl ester Formula: C17H23ClN2O5S2 MolecularWeight: 434.95792

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Descriptors Computed from Structure

Canonical SMILES:

CCOC(=O)CSCC(=O)NC1=CC(=C(C=C1)Cl)S(=O)(=O)N2CCCCC2

Isomeric SMILES

CCOC(=O)CSCC(=O)NC1=CC(=C(C=C1)Cl)S(=O)(=O)N2CCCCC2

InChI

InChI=1S/C17H23ClN2O5S2/c1-2-25-17(22)12-26-11-16(21)19-13-6-7-14(18)15(10-13)27(23,24)20-8-4-3-5-9-20/h6-7,10H,2-5,8-9,11-12H2,1H3,(H,19,21)