ethyl 2-[2-[4-(4-hydroxyphenyl)piperazin-1-yl]-2-oxidanylidene-ethyl]sulfanylethanoate

Systemtic Name: ethyl 2-[2-[4-(4-hydroxyphenyl)piperazin-1-yl]-2-oxidanylidene-ethyl]sulfanylethanoate Openeye Name: ethyl 2-[2-[4-(4-hydroxyphenyl)piperazin-1-yl]-2-oxo-ethyl]sulfanylacetate CAS Name: 2-[[2-[4-(4-hydroxyphenyl)-1-piperazinyl]-2-oxoethyl]thio]acetic acid ethyl ester IUPAC Name: ethyl 2-[2-[4-(4-hydroxyphenyl)piperazin-1-yl]-2-oxoethyl]sulfanylacetate Traditional Name: 2-[[2-[4-(4-hydroxyphenyl)piperazino]-2-keto-ethyl]thio]acetic acid ethyl ester Formula: C16H22N2O4S MolecularWeight: 338.42188

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Descriptors Computed from Structure

Canonical SMILES:

CCOC(=O)CSCC(=O)N1CCN(CC1)C2=CC=C(C=C2)O

Isomeric SMILES

CCOC(=O)CSCC(=O)N1CCN(CC1)C2=CC=C(C=C2)O

InChI

InChI=1S/C16H22N2O4S/c1-2-22-16(21)12-23-11-15(20)18-9-7-17(8-10-18)13-3-5-14(19)6-4-13/h3-6,19H,2,7-12H2,1H3