2-[2-[4-(5-chloranyl-2-methyl-phenyl)piperazin-1-yl]-2-oxidanylidene-ethyl]sulfanylethanoate

Systemtic Name: 2-[2-[4-(5-chloranyl-2-methyl-phenyl)piperazin-1-yl]-2-oxidanylidene-ethyl]sulfanylethanoate Openeye Name: 2-[2-[4-(5-chloro-2-methyl-phenyl)piperazin-1-yl]-2-oxo-ethyl]sulfanylacetate CAS Name: 2-[[2-[4-(5-chloro-2-methylphenyl)-1-piperazinyl]-2-oxoethyl]thio]acetate IUPAC Name: 2-[2-[4-(5-chloro-2-methylphenyl)piperazin-1-yl]-2-oxoethyl]sulfanylacetate Traditional Name: 2-[[2-[4-(5-chloro-2-methyl-phenyl)piperazino]-2-keto-ethyl]thio]acetate Formula: C15H18ClN2O3S- MolecularWeight: 341.83302

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CC1=C(C=C(C=C1)Cl)N2CCN(CC2)C(=O)CSCC(=O)[O-]

Isomeric SMILES

CC1=C(C=C(C=C1)Cl)N2CCN(CC2)C(=O)CSCC(=O)[O-]

InChI

InChI=1S/C15H19ClN2O3S/c1-11-2-3-12(16)8-13(11)17-4-6-18(7-5-17)14(19)9-22-10-15(20)21/h2-3,8H,4-7,9-10H2,1H3,(H,20,21)/p-1