Vitas-M small molecule compound
2-[5-({2-[(5-chloro-2-methoxyphenyl)amino]-2-oxoethyl}sulfanyl)-4-(prop-2-en-1-yl)-4H-1,2,4-triazol-3-yl]-N-[3-(trifluoromethyl)phenyl]acetamide
Catalog ID
STK186695
SMILES C=CCn1c(nnc1SCC(=O)Nc1cc(Cl)ccc1OC)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 C23H21ClF3N5O3S MW 539.97 g/mol Purity >90% as per NMR
InChI
InChI=1S/C23H21ClF3N5O3S/c1-3-9-32-19(12-20(33)28-16-6-4-5-14(10-16)23(25,26)27)30-31-22(32)36-13-21(34)29-17-11-15(24)7-8-18(17)35-2/h3-8,10-11H,1,9,12-13H2,2H3,(H,28,33)(H,29,34)InChIKey
NYSXYIOWPYKUCL-UHFFFAOYSA-NSynonyms
2(5((2((5CHLORO2METHOXYPHENYL)AMINO)2OXOETHYL)SULFANYL)4(PROP2EN1YL)4H124TRIAZOL3YL)N(3(TRIFLUOROMETHYL)PHENYL)ACETAMIDE
2(5(2(5CHLORO2METHOXYANILINO)2OXOETHYL)SULFANYL4PROP2ENYL124TRIAZOL3YL)N(3(TRIFLUOROMETHYL)PHENYL)ACETAMIDE
COC1=C(C=C(C=C1)Cl)NC(=O)CSC2=NN=C(N2CC=C)CC(=O)NC3=CC=CC(=C3)C(F)(F)F
InChI=1SC23H21ClF3N5O3Sc1393219(1220(33)281664514(1016)23(2526)27)303122(32)361321(34)29171115(24)7818(17)352h381011H191213H22H3(H2833)(H2934)
MFCD05998903
ZINC000059611971
ZINC59611971
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