Vitas-M small molecule compound
2-chloro-5-[({[4-methyl-5-(pyrazin-2-yl)-4H-1,2,4-triazol-3-yl]sulfanyl}acetyl)amino]benzoic acid
Catalog ID
STK611611
SMILES O=C(Nc1ccc(c(c1)C(=O)O)Cl)CSc1nnc(n1C)c1cnccn1
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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 C16H13ClN6O3S MW 404.84 g/mol Purity >90% as per NMR
InChI
InChI=1S/C16H13ClN6O3S/c1-23-14(12-7-18-4-5-19-12)21-22-16(23)27-8-13(24)20-9-2-3-11(17)10(6-9)15(25)26/h2-7H,8H2,1H3,(H,20,24)(H,25,26)InChIKey
FRJYFDFCGMRKJN-UHFFFAOYSA-NSynonyms
887672-65-32chloro5((((4methyl5(pyrazin2yl)4H124triazol3yl)sulfanyl)acetyl)amino)benzoicacid
2CHLORO5((2((4METHYL5PYRAZIN2YL124TRIAZOL3YL)SULFANYL)ACETYL)AMINO)BENZOICACID
2chloro5(2((4methyl5(pyrazin2yl)4H124triazol3yl)thio)acetamido)benzoicacid
887672653
CN1C(=NN=C1SCC(=O)NC2=CC(=C(C=C2)Cl)C(=O)O)C3=NC=CN=C3
InChI=1SC16H13ClN6O3Sc12314(12718451912)212216(23)27813(24)2092311(17)10(69)15(25)26h27H8H21H3(H2024)(H2526)
MFCD07400792
ZINC000004772664
ZINC4772664
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