Vitas-M small molecule compound
2-fluoro-N-[2-(4-methyl-5-{[(4-oxo-3,4-dihydroquinazolin-2-yl)methyl]sulfanyl}-4H-1,2,4-triazol-3-yl)ethyl]benzamide
Catalog ID
STK186952
SMILES O=C(c1ccccc1F)NCCc1nnc(n1C)SCc1nc2ccccc2c(=O)[nH]1
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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/c1-28-18(10-11-23-19(29)13-6-2-4-8-15(13)22)26-27-21(28)31-12-17-24-16-9-5-3-7-14(16)20(30)25-17/h2-9H,10-12H2,1H3,(H,23,29)(H,24,25,30)InChIKey
REUBIZFGACHBIN-UHFFFAOYSA-NSynonyms
2FLUORON(2(4METHYL5(((4OXO34DIHYDRO2QUINAZOLINYL)METHYL)THIO)4H124TRIAZOL3YL)ETHYL)BENZAMIDE
2FLUORON(2(4METHYL5(((4OXO34DIHYDROQUINAZOLIN2YL)METHYL)SULFANYL)4H124TRIAZOL3YL)ETHYL)BENZAMIDE
2FLUORON(2(4METHYL5((4OXO1HQUINAZOLIN2YL)METHYLSULFANYL)124TRIAZOL3YL)ETHYL)BENZAMIDE
CN1C(=NN=C1SCC2=NC(=O)C3=CC=CC=C3N2)CCNC(=O)C4=CC=CC=C4F
InChI=1SC21H19FN6O2Sc12818(10112319(29)13624815(13)22)262721(28)3112172416953714(16)20(30)2517h29H1012H21H3(H2329)(H242530)
MFCD06006342
O=C(c1ccccc1F)NCCc1nnc(n1C)SCc1nc2ccccc2c(=O)(nH)1
ZINC000008667251
ZINC08667251
ZINC8667251
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