Vitas-M small molecule compound
2-{[5-{[(4,6-dimethylpyrimidin-2-yl)sulfanyl]methyl}-4-(prop-2-en-1-yl)-4H-1,2,4-triazol-3-yl]sulfanyl}-N-[2-(trifluoromethyl)phenyl]acetamide
Catalog ID
STK844996
SMILES C=CCn1c(SCC(=O)Nc2ccccc2C(F)(F)F)nnc1CSc1nc(C)cc(n1)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 C21H21F3N6OS2 MW 494.56 g/mol Purity >90% as per NMR
InChI
InChI=1S/C21H21F3N6OS2/c1-4-9-30-17(11-32-19-25-13(2)10-14(3)26-19)28-29-20(30)33-12-18(31)27-16-8-6-5-7-15(16)21(22,23)24/h4-8,10H,1,9,11-12H2,2-3H3,(H,27,31)InChIKey
YJZUALARZHDWNE-UHFFFAOYSA-NSynonyms
637321-07-42((4allyl5(((46dimethylpyrimidin2yl)thio)methyl)4H124triazol3yl)thio)N(2(trifluoromethyl)phenyl)acetamide
2((5(((46dimethylpyrimidin2yl)sulfanyl)methyl)4(prop2en1yl)4H124triazol3yl)sulfanyl)N(2(trifluoromethyl)phenyl)acetamide
2((5((46DIMETHYLPYRIMIDIN2YL)SULFANYLMETHYL)4PROP2ENYL124TRIAZOL3YL)SULFANYL)N(2(TRIFLUOROMETHYL)PHENYL)ACETAMIDE
2(5((46DIMETHYLPYRIMIDIN2YLTHIO)METHYL)4PROP2ENYL(124TRIAZOL3YLTHIO))N(2(TRIFLUOROMETHYL)PHENYL)ACETAMIDE
637321074
CC1=CC(=NC(=N1)SCC2=NN=C(N2CC=C)SCC(=O)NC3=CC=CC=C3C(F)(F)F)C
InChI=1SC21H21F3N6OS2c1493017(1132192513(2)1014(3)2619)282920(30)331218(31)2716865715(16)21(2223)24h4810H191112H223H3(H2731)
MFCD04009138
ZINC000001109525
ZINC01109525
ZINC1109525
Check stock
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Check stock on Vitas-MAvailable files
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