Vitas-M small molecule compound
2-{[5-(3-fluorophenyl)-4-methyl-4H-1,2,4-triazol-3-yl]sulfanyl}-1-[4-(4-fluorophenyl)piperazin-1-yl]ethanone
Catalog ID
STK297330
SMILES Fc1ccc(cc1)N1CCN(CC1)C(=O)CSc1nnc(n1C)c1cccc(c1)F
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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 C21H21F2N5OS MW 429.49 g/mol Purity >90% as per NMR
InChI
InChI=1S/C21H21F2N5OS/c1-26-20(15-3-2-4-17(23)13-15)24-25-21(26)30-14-19(29)28-11-9-27(10-12-28)18-7-5-16(22)6-8-18/h2-8,13H,9-12,14H2,1H3InChIKey
AXVVPWGTKDKZNX-UHFFFAOYSA-NSynonyms
2((5(3fluorophenyl)4methyl124triazol3yl)sulfanyl)1(4(4fluorophenyl)piperazin1yl)ethanone
2((5(3fluorophenyl)4methyl4H124triazol3yl)sulfanyl)1(4(4fluorophenyl)piperazin1yl)ethanone
2(5(3FLUOROPHENYL)4METHYL4H(124)TRIAZOL3YLSULFANYL)1(4(4FLUOROPHENYL)PIPERAZIN1YL)ETHANONE
CN1C(=NN=C1SCC(=O)N2CCN(CC2)C3=CC=C(C=C3)F)C4=CC(=CC=C4)F
InChI=1SC21H21F2N5OSc12620(1532417(23)1315)242521(26)301419(29)2811927(101228)187516(22)6818h2813H91214H21H3
MFCD09960913
ZINC000013956256
ZINC13956256
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