N'-[3-(4-chlorophenyl)sulfanylpropyl]ethane-1,2-diamine; ethanedioic acid

Systemtic Name: N'-[3-(4-chlorophenyl)sulfanylpropyl]ethane-1,2-diamine; ethanedioic acid Openeye Name: N'-[3-(4-chlorophenyl)sulfanylpropyl]ethane-1,2-diamine; oxalic acid CAS Name: N'-[3-[(4-chlorophenyl)thio]propyl]ethane-1,2-diamine; oxalic acid IUPAC Name: N'-[3-(4-chlorophenyl)sulfanylpropyl]ethane-1,2-diamine; oxalic acid Traditional Name: 2-aminoethyl-[3-[(4-chlorophenyl)thio]propyl]amine; oxalic acid Formula: C13H19ClN2O4S MolecularWeight: 334.81896

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC(=CC=C1SCCCNCCN)Cl.C(=O)(C(=O)O)O

Isomeric SMILES

C1=CC(=CC=C1SCCCNCCN)Cl.C(=O)(C(=O)O)O

InChI

InChI=1S/C11H17ClN2S.C2H2O4/c12-10-2-4-11(5-3-10)15-9-1-7-14-8-6-13;3-1(4)2(5)6/h2-5,14H,1,6-9,13H2;(H,3,4)(H,5,6)