Vitas-M small molecule compound
3-({5-[(E)-(2-carbamothioylhydrazinylidene)methyl]-4-chloro-2-oxo-1,3-thiazol-3(2H)-yl}methyl)benzoic acid
Catalog ID
STK201782
SMILES NC(=S)N/N=C/c1sc(=O)n(c1Cl)Cc1cccc(c1)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 C13H11ClN4O3S2 MW 370.84 g/mol Purity >90% as per NMR
InChI
InChI=1S/C13H11ClN4O3S2/c14-10-9(5-16-17-12(15)22)23-13(21)18(10)6-7-2-1-3-8(4-7)11(19)20/h1-5H,6H2,(H,19,20)(H3,15,17,22)/b16-5+InChIKey
HQUSFBUMQHZVFE-FZSIALSZSA-NSynonyms
3((5((1E)2((AMINOTHIOXOMETHYL)AMINO)2AZAVINYL)4CHLORO2OXO13THIAZOLIN3YL)METHYL)BENZOICACID
3((5((E)(2CARBAMOTHIOYLHYDRAZINYLIDENE)METHYL)4CHLORO2OXO13THIAZOL3(2H)YL)METHYL)BENZOICACID
3((5((E)(carbamothioylhydrazinylidene)methyl)4chloro2oxo13thiazol3yl)methyl)benzoicacid
C1=CC(=CC(=C1)CN2C(=C(SC2=O)C=NNC(=S)N)Cl)C(=O)O
InChI=1SC13H11ClN4O3S2c14109(5161712(15)22)2313(21)18(10)672138(47)11(19)20h15H6H2(H1920)(H3151722)b165+
MFCD06644252
NC(=S)NN=Cc1sc(=O)n(c1Cl)Cc1cccc(c1)C(=O)O
ZINC000004739887
ZINC36145116
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