ethanedioic acid; 2-[2-[(4-phenyl-1,3-thiazol-2-yl)sulfanyl]ethylamino]ethanol

Systemtic Name: ethanedioic acid; 2-[2-[(4-phenyl-1,3-thiazol-2-yl)sulfanyl]ethylamino]ethanol Openeye Name: oxalic acid; 2-[2-(4-phenylthiazol-2-yl)sulfanylethylamino]ethanol CAS Name: oxalic acid; 2-[2-[(4-phenyl-2-thiazolyl)thio]ethylamino]ethanol IUPAC Name: oxalic acid; 2-[2-[(4-phenyl-1,3-thiazol-2-yl)sulfanyl]ethylamino]ethanol Traditional Name: oxalic acid; 2-[2-[(4-phenylthiazol-2-yl)thio]ethylamino]ethanol Formula: C15H18N2O5S2 MolecularWeight: 370.44382

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC=C(C=C1)C2=CSC(=N2)SCCNCCO.C(=O)(C(=O)O)O

Isomeric SMILES

C1=CC=C(C=C1)C2=CSC(=N2)SCCNCCO.C(=O)(C(=O)O)O

InChI

InChI=1S/C13H16N2OS2.C2H2O4/c16-8-6-14-7-9-17-13-15-12(10-18-13)11-4-2-1-3-5-11;3-1(4)2(5)6/h1-5,10,14,16H,6-9H2;(H,3,4)(H,5,6)