Vitas-M small molecule compound
2-[5-({2-[(4-methoxyphenyl)amino]-2-oxoethyl}sulfanyl)-4-methyl-4H-1,2,4-triazol-3-yl]-N-[3-(trifluoromethyl)phenyl]acetamide
Catalog ID
STK151588
SMILES COc1ccc(cc1)NC(=O)CSc1nnc(n1C)CC(=O)Nc1cccc(c1)C(F)(F)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 C21H20F3N5O3S MW 479.48 g/mol Purity >90% as per NMR
InChI
InChI=1S/C21H20F3N5O3S/c1-29-17(11-18(30)26-15-5-3-4-13(10-15)21(22,23)24)27-28-20(29)33-12-19(31)25-14-6-8-16(32-2)9-7-14/h3-10H,11-12H2,1-2H3,(H,25,31)(H,26,30)InChIKey
LMTNMMWZSLUWCD-UHFFFAOYSA-NSynonyms
2(5((2((4METHOXYPHENYL)AMINO)2OXOETHYL)SULFANYL)4METHYL4H124TRIAZOL3YL)N(3(TRIFLUOROMETHYL)PHENYL)ACETAMIDE
2(5(2(4METHOXYANILINO)2OXOETHYL)SULFANYL4METHYL124TRIAZOL3YL)N(3(TRIFLUOROMETHYL)PHENYL)ACETAMIDE
CN1C(=NN=C1SCC(=O)NC2=CC=C(C=C2)OC)CC(=O)NC3=CC=CC(=C3)C(F)(F)F
InChI=1SC21H20F3N5O3Sc12917(1118(30)261553413(1015)21(2223)24)272820(29)331219(31)25146816(322)9714h310H1112H212H3(H2531)(H2630)
MFCD05998915
ZINC000002867044
ZINC02867044
ZINC2867044
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