1-[2-(4-chlorophenyl)sulfanylethyl]-4-methyl-piperazine; ethanedioic acid

Systemtic Name: 1-[2-(4-chlorophenyl)sulfanylethyl]-4-methyl-piperazine; ethanedioic acid Openeye Name: 1-[2-(4-chlorophenyl)sulfanylethyl]-4-methyl-piperazine; oxalic acid CAS Name: 1-[2-[(4-chlorophenyl)thio]ethyl]-4-methylpiperazine; oxalic acid IUPAC Name: 1-[2-(4-chlorophenyl)sulfanylethyl]-4-methylpiperazine; oxalic acid Traditional Name: 1-[2-[(4-chlorophenyl)thio]ethyl]-4-methyl-piperazine; oxalic acid Formula: C15H21ClN2O4S MolecularWeight: 360.85624

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Descriptors Computed from Structure

Canonical SMILES:

CN1CCN(CC1)CCSC2=CC=C(C=C2)Cl.C(=O)(C(=O)O)O

Isomeric SMILES

CN1CCN(CC1)CCSC2=CC=C(C=C2)Cl.C(=O)(C(=O)O)O

InChI

InChI=1S/C13H19ClN2S.C2H2O4/c1-15-6-8-16(9-7-15)10-11-17-13-4-2-12(14)3-5-13;3-1(4)2(5)6/h2-5H,6-11H2,1H3;(H,3,4)(H,5,6)