Vitas-M small molecule compound
3-[3-(quinolin-2-yl)-5-sulfanyl-4H-1,2,4-triazol-4-yl]benzoic acid
Catalog ID
STK772440
SMILES OC(=O)c1cccc(c1)n1c(S)nnc1c1ccc2c(n1)cccc2
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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 C18H12N4O2S MW 348.39 g/mol Purity >90% as per NMR
InChI
InChI=1S/C18H12N4O2S/c23-17(24)12-5-3-6-13(10-12)22-16(20-21-18(22)25)15-9-8-11-4-1-2-7-14(11)19-15/h1-10H,(H,21,25)(H,23,24)InChIKey
ORYNPGPZJOPFHH-UHFFFAOYSA-NSynonyms
634169-36-13(3(quinolin2yl)5sulfanyl4H124triazol4yl)benzoicacid
3(3mercapto5(quinolin2yl)4H124triazol4yl)benzoicacid
3(3QUINOLIN2YL5SULFANYLIDENE1H124TRIAZOL4YL)BENZOICACID
634169361
C1=CC=C2C(=C1)C=CC(=N2)C3=NNC(=S)N3C4=CC=CC(=C4)C(=O)O
InChI=1SC18H12N4O2Sc2317(24)1253613(1012)2216(202118(22)25)159811412714(11)1915h110H(H2125)(H2324)
MFCD03675580
ZINC000005927648
ZINC5927648
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