ethanedioic acid; 2-[[4-(4-fluorophenyl)-1,3-thiazol-2-yl]sulfanyl]ethanamine

Systemtic Name: ethanedioic acid; 2-[[4-(4-fluorophenyl)-1,3-thiazol-2-yl]sulfanyl]ethanamine Openeye Name: 2-[4-(4-fluorophenyl)thiazol-2-yl]sulfanylethanamine; oxalic acid CAS Name: 2-[[4-(4-fluorophenyl)-2-thiazolyl]thio]ethanamine; oxalic acid IUPAC Name: 2-[[4-(4-fluorophenyl)-1,3-thiazol-2-yl]sulfanyl]ethanamine; oxalic acid Traditional Name: 2-[[4-(4-fluorophenyl)thiazol-2-yl]thio]ethylamine; oxalic acid Formula: C13H13FN2O4S2 MolecularWeight: 344.381723

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC(=CC=C1C2=CSC(=N2)SCCN)F.C(=O)(C(=O)O)O

Isomeric SMILES

C1=CC(=CC=C1C2=CSC(=N2)SCCN)F.C(=O)(C(=O)O)O

InChI

InChI=1S/C11H11FN2S2.C2H2O4/c12-9-3-1-8(2-4-9)10-7-16-11(14-10)15-6-5-13;3-1(4)2(5)6/h1-4,7H,5-6,13H2;(H,3,4)(H,5,6)