Vitas-M small molecule compound
2-{[4-methyl-5-(morpholin-4-ylmethyl)-4H-1,2,4-triazol-3-yl]sulfanyl}-N-[2-(morpholin-4-yl)-5-(trifluoromethyl)phenyl]acetamide
Catalog ID
STK284609
SMILES O=C(Nc1cc(ccc1N1CCOCC1)C(F)(F)F)CSc1nnc(n1C)CN1CCOCC1
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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 C21H27F3N6O3S MW 500.55 g/mol Purity >90% as per NMR
InChI
InChI=1S/C21H27F3N6O3S/c1-28-18(13-29-4-8-32-9-5-29)26-27-20(28)34-14-19(31)25-16-12-15(21(22,23)24)2-3-17(16)30-6-10-33-11-7-30/h2-3,12H,4-11,13-14H2,1H3,(H,25,31)InChIKey
NDFRAIYZAUSATM-UHFFFAOYSA-NSynonyms
2((4METHYL5(MORPHOLIN4YLMETHYL)124TRIAZOL3YL)SULFANYL)N(2MORPHOLIN4YL5(TRIFLUOROMETHYL)PHENYL)ACETAMIDE
2((4methyl5(morpholin4ylmethyl)4H124triazol3yl)sulfanyl)N(2(morpholin4yl)5(trifluoromethyl)phenyl)acetamide
CN1C(=NN=C1SCC(=O)NC2=C(C=CC(=C2)C(F)(F)F)N3CCOCC3)CN4CCOCC4
InChI=1SC21H27F3N6O3Sc12818(132948329529)262720(28)341419(31)25161215(21(2223)24)2317(16)306103311730h2312H4111314H21H3(H2531)
MFCD07359062
ZINC000019799616
ZINC19799616
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