Vitas-M small molecule compound
1-(butan-2-yl)-5-(difluoromethyl)-7-(3,4-dimethylphenyl)-2-sulfanylpyrido[2,3-d]pyrimidin-4(1H)-one
Catalog ID
STL179247
SMILES CCC(n1c(S)nc(=O)c2c1nc(cc2C(F)F)c1ccc(c(c1)C)C)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 C20H21F2N3OS MW 389.47 g/mol Purity >90% as per NMR
InChI
InChI=1S/C20H21F2N3OS/c1-5-12(4)25-18-16(19(26)24-20(25)27)14(17(21)22)9-15(23-18)13-7-6-10(2)11(3)8-13/h6-9,12,17H,5H2,1-4H3,(H,24,26,27)InChIKey
UDBAWHNMKIXBDY-UHFFFAOYSA-NSynonyms
1(butan2yl)5(difluoromethyl)7(34dimethylphenyl)2sulfanylpyrido(23d)pyrimidin4(1H)one
1butan2yl5(difluoromethyl)7(34dimethylphenyl)2sulfanylidenepyrido(23d)pyrimidin4one
CCC(C)N1C2=C(C(=CC(=N2)C3=CC(=C(C=C3)C)C)C(F)F)C(=O)NC1=S
InChI=1SC20H21F2N3OSc1512(4)251816(19(26)2420(25)27)14(17(21)22)915(2318)137610(2)11(3)813h691217H5H214H3(H242627)
MFCD09472600
ZINC000020603566
ZINC000020603569
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