Vitas-M small molecule compound
4-(1,3-benzoxazol-2-ylsulfanyl)but-2-yn-1-yl 4-fluorobenzoate
Catalog ID
STK177461
SMILES Fc1ccc(cc1)C(=O)OCC#CCSc1nc2c(o1)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 C18H12FNO3S MW 341.36 g/mol Purity >90% as per NMR
InChI
InChI=1S/C18H12FNO3S/c19-14-9-7-13(8-10-14)17(21)22-11-3-4-12-24-18-20-15-5-1-2-6-16(15)23-18/h1-2,5-10H,11-12H2InChIKey
KYVXNMRRLSJYNV-UHFFFAOYSA-NSynonyms
669715-68-84(13BENZOXAZOL2YLSULFANYL)BUT2YN1YL4FLUOROBENZOATE
4(13BENZOXAZOL2YLSULFANYL)BUT2YNYL4FLUOROBENZOATE
4(benzo(d)oxazol2ylthio)but2yn1yl4fluorobenzoate
4FLUOROBENZOICACID4(BENZOOXAZOL2YLSULFANYL)BUT2YNYLESTER
669715688
C1=CC=C2C(=C1)N=C(O2)SCC#CCOC(=O)C3=CC=C(C=C3)F
InChI=1SC18H12FNO3Sc19149713(81014)17(21)2211341224182015512616(15)2318h12510H1112H2
MFCD03667638
ZINC000004559499
ZINC04559499
ZINC4559499
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