Vitas-M small molecule compound
3-[4-bromo-5-methyl-3-(trifluoromethyl)-1H-pyrazol-1-yl]-N-(2,6-dimethyl-4-oxothieno[2,3-d]pyrimidin-3(4H)-yl)propanamide
Catalog ID
STK304593
SMILES O=C(Nn1c(C)nc2c(c1=O)cc(s2)C)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 C16H15BrF3N5O2S MW 478.29 g/mol Purity >90% as per NMR
InChI
InChI=1S/C16H15BrF3N5O2S/c1-7-6-10-14(28-7)21-9(3)25(15(10)27)22-11(26)4-5-24-8(2)12(17)13(23-24)16(18,19)20/h6H,4-5H2,1-3H3,(H,22,26)InChIKey
QZNZYWSFVZKTCQ-UHFFFAOYSA-NSynonyms
1005601-32-01005601320
3(4bromo5methyl3(trifluoromethyl)1Hpyrazol1yl)N(26dimethyl4oxothieno(23d)pyrimidin3(4H)yl)propanamide
3(4bromo5methyl3(trifluoromethyl)pyrazol1yl)N(26dimethyl4oxothieno(23d)pyrimidin3yl)propanamide
CC1=CC2=C(S1)N=C(N(C2=O)NC(=O)CCN3C(=C(C(=N3)C(F)(F)F)Br)C)C
InChI=1SC16H15BrF3N5O2Sc1761014(287)219(3)25(15(10)27)2211(26)45248(2)12(17)13(2324)16(1819)20h6H45H213H3(H2226)
MFCD04044803
ZINC000002781455
ZINC02781455
ZINC2781455
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