Vitas-M small molecule compound
3-[4-bromo-5-methyl-3-(trifluoromethyl)-1H-pyrazol-1-yl]-N-(2-methyl-4-oxo-5,6,7,8-tetrahydro[1]benzothieno[2,3-d]pyrimidin-3(4H)-yl)propanamide
Catalog ID
STK304582
SMILES O=C(Nn1c(C)nc2c(c1=O)c1CCCCc1s2)CCn1nc(c(c1C)Br)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 C19H19BrF3N5O2S MW 518.36 g/mol Purity >90% as per NMR
InChI
InChI=1S/C19H19BrF3N5O2S/c1-9-15(20)16(19(21,22)23)26-27(9)8-7-13(29)25-28-10(2)24-17-14(18(28)30)11-5-3-4-6-12(11)31-17/h3-8H2,1-2H3,(H,25,29)InChIKey
CKNFVTURRLDQJE-UHFFFAOYSA-NSynonyms
1005643-19-51005643195
3(4bromo5methyl3(trifluoromethyl)1Hpyrazol1yl)N(2methyl4oxo5678tetrahydro(1)benzothieno(23d)pyrimidin3(4H)yl)propanamide
3(4bromo5methyl3(trifluoromethyl)pyrazol1yl)N(2methyl4oxo5678tetrahydro(1)benzothiolo(23d)pyrimidin3yl)propanamide
CC1=C(C(=NN1CCC(=O)NN2C(=NC3=C(C2=O)C4=C(S3)CCCC4)C)C(F)(F)F)Br
InChI=1SC19H19BrF3N5O2Sc1915(20)16(19(2122)23)2627(9)8713(29)252810(2)241714(18(28)30)11534612(11)3117h38H212H3(H2529)
MFCD04042772
ZINC000002781428
ZINC02781428
ZINC2781428
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