Vitas-M small molecule compound
2-[5-({2-[(5-chloro-2-methoxyphenyl)amino]-2-oxoethyl}sulfanyl)-4-methyl-4H-1,2,4-triazol-3-yl]-N-[3-(trifluoromethyl)phenyl]acetamide
Catalog ID
STK151583
SMILES COc1ccc(cc1NC(=O)CSc1nnc(n1C)CC(=O)Nc1cccc(c1)C(F)(F)F)Cl
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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 C21H19ClF3N5O3S MW 513.93 g/mol Purity >90% as per NMR
InChI
InChI=1S/C21H19ClF3N5O3S/c1-30-17(10-18(31)26-14-5-3-4-12(8-14)21(23,24)25)28-29-20(30)34-11-19(32)27-15-9-13(22)6-7-16(15)33-2/h3-9H,10-11H2,1-2H3,(H,26,31)(H,27,32)InChIKey
USPRLLHYYRKQRM-UHFFFAOYSA-NSynonyms
2(5((2((5CHLORO2METHOXYPHENYL)AMINO)2OXOETHYL)SULFANYL)4METHYL4H124TRIAZOL3YL)N(3(TRIFLUOROMETHYL)PHENYL)ACETAMIDE
2(5(2(5CHLORO2METHOXYANILINO)2OXOETHYL)SULFANYL4METHYL124TRIAZOL3YL)N(3(TRIFLUOROMETHYL)PHENYL)ACETAMIDE
CN1C(=NN=C1SCC(=O)NC2=C(C=CC(=C2)Cl)OC)CC(=O)NC3=CC=CC(=C3)C(F)(F)F
InChI=1SC21H19ClF3N5O3Sc13017(1018(31)261453412(814)21(2324)25)282920(30)341119(32)2715913(22)6716(15)332h39H1011H212H3(H2631)(H2732)
MFCD05998902
ZINC000002867023
ZINC02867023
ZINC2867023
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