Vitas-M small molecule compound
3-{5-[(E)-(2-carbamothioylhydrazinylidene)methyl]furan-2-yl}-4-chlorobenzoic acid
Catalog ID
STK200985
SMILES NC(=S)N/N=C/c1ccc(o1)c1cc(ccc1Cl)C(=O)O
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We supply compounds in quantities from 1 mg up to 5 g for research and development purposes only.
We do not supply quantities above 5 g.
Structure and other identifiers
2D representation rendered from the SMILES, with core physicochemical data.Formula C13H10ClN3O3S MW 323.76 g/mol Purity >90% as per NMR
InChI
InChI=1S/C13H10ClN3O3S/c14-10-3-1-7(12(18)19)5-9(10)11-4-2-8(20-11)6-16-17-13(15)21/h1-6H,(H,18,19)(H3,15,17,21)/b16-6+InChIKey
ZVWAWSPWVCDCIL-OMCISZLKSA-NSynonyms
384797-05-1(E)3(5((2carbamothioylhydrazono)methyl)furan2yl)4chlorobenzoicacid
3(5((E)(2CARBAMOTHIOYLHYDRAZINYLIDENE)METHYL)FURAN2YL)4CHLOROBENZOICACID
3(5((E)(CARBAMOTHIOYLHYDRAZINYLIDENE)METHYL)FURAN2YL)4CHLOROBENZOICACID
384797051
C1=CC(=C(C=C1C(=O)O)C2=CC=C(O2)C=NNC(=S)N)Cl
InChI=1SC13H10ClN3O3Sc1410317(12(18)19)59(10)11428(2011)6161713(15)21h16H(H1819)(H3151721)b166+
MFCD03160364
NC(=S)NN=Cc1ccc(o1)c1cc(ccc1Cl)C(=O)O
ZINC000004739647
ZINC7043553
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