Vitas-M small molecule compound
7-(4-bromophenyl)-5-(difluoromethyl)-1-(2-methoxyphenyl)-2-sulfanylpyrido[2,3-d]pyrimidin-4(1H)-one
Catalog ID
STL179125
SMILES COc1ccccc1n1c(S)nc(=O)c2c1nc(cc2C(F)F)c1ccc(cc1)Br
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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 C21H14BrF2N3O2S MW 490.33 g/mol Purity >90% as per NMR
InChI
InChI=1S/C21H14BrF2N3O2S/c1-29-16-5-3-2-4-15(16)27-19-17(20(28)26-21(27)30)13(18(23)24)10-14(25-19)11-6-8-12(22)9-7-11/h2-10,18H,1H3,(H,26,28,30)InChIKey
QKJMETNHTFVOKT-UHFFFAOYSA-NSynonyms
1011384-55-61011384556
7(4bromophenyl)5(difluoromethyl)1(2methoxyphenyl)2sulfanylidenepyrido(23d)pyrimidin4one
7(4bromophenyl)5(difluoromethyl)1(2methoxyphenyl)2sulfanylpyrido(23d)pyrimidin4(1H)one
COC1=CC=CC=C1N2C3=C(C(=CC(=N3)C4=CC=C(C=C4)Br)C(F)F)C(=O)NC2=S
InChI=1SC21H14BrF2N3O2Sc12916532415(16)271917(20(28)2621(27)30)13(18(23)24)1014(2519)116812(22)9711h21018H1H3(H262830)
MFCD09472771
ZINC000020602910
ZINC20602910
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