methyl 2-[2-oxidanylidene-2-[(4-piperidin-1-ylphenyl)amino]ethyl]sulfanylethanoate

Systemtic Name: methyl 2-[2-oxidanylidene-2-[(4-piperidin-1-ylphenyl)amino]ethyl]sulfanylethanoate Openeye Name: methyl 2-[2-oxo-2-[4-(1-piperidyl)anilino]ethyl]sulfanylacetate CAS Name: 2-[[2-oxo-2-[4-(1-piperidinyl)anilino]ethyl]thio]acetic acid methyl ester IUPAC Name: methyl 2-[2-oxo-2-(4-piperidin-1-ylanilino)ethyl]sulfanylacetate Traditional Name: 2-[[2-keto-2-(4-piperidinoanilino)ethyl]thio]acetic acid methyl ester Formula: C16H22N2O3S MolecularWeight: 322.42248

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C16H22N2O3S/c1-21-16(20)12-22-11-15(19)17-13-5-7-14(8-6-13)18-9-3-2-4-10-18/h5-8H,2-4,9-12H2,1H3,(H,17,19)