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

Systemtic Name: ethyl 2-[2-[(4-methyl-3-piperidin-1-ylsulfonyl-phenyl)amino]-2-oxidanylidene-ethyl]sulfanylethanoate Openeye Name: ethyl 2-[2-[4-methyl-3-(1-piperidylsulfonyl)anilino]-2-oxo-ethyl]sulfanylacetate CAS Name: 2-[[2-[4-methyl-3-(1-piperidinylsulfonyl)anilino]-2-oxoethyl]thio]acetic acid ethyl ester IUPAC Name: ethyl 2-[2-(4-methyl-3-piperidin-1-ylsulfonylanilino)-2-oxoethyl]sulfanylacetate Traditional Name: 2-[[2-keto-2-(4-methyl-3-piperidinosulfonyl-anilino)ethyl]thio]acetic acid ethyl ester Formula: C18H26N2O5S2 MolecularWeight: 414.53944

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C18H26N2O5S2/c1-3-25-18(22)13-26-12-17(21)19-15-8-7-14(2)16(11-15)27(23,24)20-9-5-4-6-10-20/h7-8,11H,3-6,9-10,12-13H2,1-2H3,(H,19,21)