Vitas-M small molecule compound
propan-2-yl 4-ethyl-5-methyl-2-[({1-[4-(1-methyl-1H-pyrazol-4-yl)-6-(trifluoromethyl)pyrimidin-2-yl]-1H-pyrazol-3-yl}carbonyl)amino]thiophene-3-carboxylate
Catalog ID
STK314344
SMILES CCc1c(C)sc(c1C(=O)OC(C)C)NC(=O)c1ccn(n1)c1nc(cc(n1)C(F)(F)F)c1cnn(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 C24H24F3N7O3S MW 547.56 g/mol Purity >90% as per NMR
InChI
InChI=1S/C24H24F3N7O3S/c1-6-15-13(4)38-21(19(15)22(36)37-12(2)3)31-20(35)16-7-8-34(32-16)23-29-17(14-10-28-33(5)11-14)9-18(30-23)24(25,26)27/h7-12H,6H2,1-5H3,(H,31,35)InChIKey
CICCTYYKJQMHDU-UHFFFAOYSA-NSynonyms
1005592-92-61005592926
CCC1=C(SC(=C1C(=O)OC(C)C)NC(=O)C2=NN(C=C2)C3=NC(=CC(=N3)C(F)(F)F)C4=CN(N=C4)C)C
InChI=1SC24H24F3N7O3Sc161513(4)3821(19(15)22(36)3712(2)3)3120(35)167834(3216)232917(14102833(5)1114)918(3023)24(2526)27h712H6H215H3(H3135)
MFCD05667733
propan2yl4ethyl5methyl2(((1(4(1methyl1Hpyrazol4yl)6(trifluoromethyl)pyrimidin2yl)1Hpyrazol3yl)carbonyl)amino)thiophene3carboxylate
propan2yl4ethyl5methyl2((1(4(1methylpyrazol4yl)6(trifluoromethyl)pyrimidin2yl)pyrazole3carbonyl)amino)thiophene3carboxylate
ZINC000002733800
ZINC2733800
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