Vitas-M small molecule compound
2-{[5-(3-methylphenyl)-4-(propan-2-yl)-4H-1,2,4-triazol-3-yl]sulfanyl}-N-[3-(trifluoromethyl)phenyl]acetamide
Catalog ID
STK187028
SMILES O=C(Nc1cccc(c1)C(F)(F)F)CSc1nnc(n1C(C)C)c1cccc(c1)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 C21H21F3N4OS MW 434.49 g/mol Purity >90% as per NMR
InChI
InChI=1S/C21H21F3N4OS/c1-13(2)28-19(15-7-4-6-14(3)10-15)26-27-20(28)30-12-18(29)25-17-9-5-8-16(11-17)21(22,23)24/h4-11,13H,12H2,1-3H3,(H,25,29)InChIKey
WMFLMAGYMACKCF-UHFFFAOYSA-NSynonyms
2((5(3METHYLPHENYL)4(PROPAN2YL)4H124TRIAZOL3YL)SULFANYL)N(3(TRIFLUOROMETHYL)PHENYL)ACETAMIDE
2((5(3methylphenyl)4propan2yl124triazol3yl)sulfanyl)N(3(trifluoromethyl)phenyl)acetamide
CC1=CC=CC(=C1)C2=NN=C(N2C(C)C)SCC(=O)NC3=CC=CC(=C3)C(F)(F)F
InChI=1SC21H21F3N4OSc113(2)2819(1574614(3)1015)262720(28)301218(29)251795816(1117)21(2223)24h41113H12H213H3(H2529)
MFCD06665908
ZINC000009262817
ZINC09262817
ZINC9262817
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