Vitas-M small molecule compound
5-[3-(5-bromopyridin-3-yl)-5-thioxo-1,5-dihydro-4H-1,2,4-triazol-4-yl]-2-chlorobenzoic acid
Catalog ID
STK638044
SMILES Brc1cncc(c1)c1n[nH]c(=S)n1c1ccc(c(c1)C(=O)O)Cl
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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 C14H8BrClN4O2S MW 411.67 g/mol Purity >90% as per NMR
InChI
InChI=1S/C14H8BrClN4O2S/c15-8-3-7(5-17-6-8)12-18-19-14(23)20(12)9-1-2-11(16)10(4-9)13(21)22/h1-6H,(H,19,23)(H,21,22)InChIKey
RENQNWMGSMQKMZ-UHFFFAOYSA-NSynonyms
1010892-22-41010892224
5(3(5bromopyridin3yl)5sulfanylidene1H124triazol4yl)2chlorobenzoicacid
5(3(5bromopyridin3yl)5thioxo15dihydro4H124triazol4yl)2chlorobenzoicacid
Brc1cncc(c1)c1n(nH)c(=S)n1c1ccc(c(c1)C(=O)O)Cl
C1=CC(=C(C=C1N2C(=NNC2=S)C3=CC(=CN=C3)Br)C(=O)O)Cl
InChI=1SC14H8BrClN4O2Sc15837(51768)12181914(23)20(12)91211(16)10(49)13(21)22h16H(H1923)(H2122)
MFCD18161563
ZINC000012321358
ZINC12321358
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