Vitas-M small molecule compound
2-[4-chloro-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)acetamide
Catalog ID
STK304333
SMILES O=C(Nn1c(C)nc2c(c1=O)c1CCCCc1s2)Cn1nc(c(c1C)Cl)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 C18H17ClF3N5O2S MW 459.88 g/mol Purity >90% as per NMR
InChI
InChI=1S/C18H17ClF3N5O2S/c1-8-14(19)15(18(20,21)22)25-26(8)7-12(28)24-27-9(2)23-16-13(17(27)29)10-5-3-4-6-11(10)30-16/h3-7H2,1-2H3,(H,24,28)InChIKey
IUDHZQXEHMOMRF-UHFFFAOYSA-NSynonyms
1005617-38-81005617388
2(4chloro5methyl3(trifluoromethyl)1Hpyrazol1yl)N(2methyl4oxo5678tetrahydro(1)benzothieno(23d)pyrimidin3(4H)yl)acetamide
2(4chloro5methyl3(trifluoromethyl)pyrazol1yl)N(2methyl4oxo5678tetrahydro(1)benzothiolo(23d)pyrimidin3yl)acetamide
CC1=C(C(=NN1CC(=O)NN2C(=NC3=C(C2=O)C4=C(S3)CCCC4)C)C(F)(F)F)Cl
InChI=1SC18H17ClF3N5O2Sc1814(19)15(18(2021)22)2526(8)712(28)24279(2)231613(17(27)29)10534611(10)3016h37H212H3(H2428)
MFCD04043802
ZINC000002780686
ZINC02780686
ZINC2780686
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