Vitas-M small molecule compound
N-(3-cyano-6-ethyl-4,5,6,7-tetrahydro-1-benzothiophen-2-yl)-1-[4-(1-methyl-1H-pyrazol-4-yl)-6-(trifluoromethyl)pyrimidin-2-yl]-1H-pyrazole-3-carboxamide
Catalog ID
STL398151
SMILES CCC1CCc2c(C1)sc(c2C#N)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 C24H21F3N8OS MW 526.55 g/mol Purity >90% as per NMR
InChI
InChI=1S/C24H21F3N8OS/c1-3-13-4-5-15-16(10-28)22(37-19(15)8-13)32-21(36)17-6-7-35(33-17)23-30-18(14-11-29-34(2)12-14)9-20(31-23)24(25,26)27/h6-7,9,11-13H,3-5,8H2,1-2H3,(H,32,36)InChIKey
ZXVFBWYTJCCXSR-UHFFFAOYSA-NSynonyms
1006335-75-61006335756
CCC1CCC2=C(C1)SC(=C2C#N)NC(=O)C3=NN(C=C3)C4=NC(=CC(=N4)C(F)(F)F)C5=CN(N=C5)C
InChI=1SC24H21F3N8OSc1313451516(1028)22(3719(15)813)3221(36)176735(3317)233018(14112934(2)1214)920(3123)24(2526)27h6791113H358H212H3(H3236)
MFCD08553965
N(3cyano6ethyl4567tetrahydro1benzothiophen2yl)1(4(1methyl1Hpyrazol4yl)6(trifluoromethyl)pyrimidin2yl)1Hpyrazole3carboxamide
N(3cyano6ethyl4567tetrahydro1benzothiophen2yl)1(4(1methylpyrazol4yl)6(trifluoromethyl)pyrimidin2yl)pyrazole3carboxamide
ZINC000097945432
ZINC000097945433
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