Vitas-M small molecule compound
2-fluoro-N-[1-(4-methyl-5-{[(4-oxo-3,4-dihydroquinazolin-2-yl)methyl]sulfanyl}-4H-1,2,4-triazol-3-yl)ethyl]benzamide
Catalog ID
STK218559
SMILES O=C(c1ccccc1F)NC(c1nnc(n1C)SCc1nc2ccccc2c(=O)[nH]1)C
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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 C21H19FN6O2S MW 438.49 g/mol Purity >90% as per NMR
InChI
InChI=1S/C21H19FN6O2S/c1-12(23-19(29)13-7-3-5-9-15(13)22)18-26-27-21(28(18)2)31-11-17-24-16-10-6-4-8-14(16)20(30)25-17/h3-10,12H,11H2,1-2H3,(H,23,29)(H,24,25,30)InChIKey
ZYQNSJJSVZYJKZ-UHFFFAOYSA-NSynonyms
2FLUORON(1(4METHYL5(((4OXO34DIHYDROQUINAZOLIN2YL)METHYL)SULFANYL)4H124TRIAZOL3YL)ETHYL)BENZAMIDE
2FLUORON(1(4METHYL5((4OXO1HQUINAZOLIN2YL)METHYLSULFANYL)124TRIAZOL3YL)ETHYL)BENZAMIDE
CC(C1=NN=C(N1C)SCC2=NC(=O)C3=CC=CC=C3N2)NC(=O)C4=CC=CC=C4F
InChI=1SC21H19FN6O2Sc112(2319(29)13735915(13)22)18262721(28(18)2)31111724161064814(16)20(30)2517h31012H11H212H3(H2329)(H242530)
MFCD07189160
O=C(c1ccccc1F)NC(c1nnc(n1C)SCc1nc2ccccc2c(=O)(nH)1)C
ZINC000018219717
ZINC000018219719
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