Vitas-M small molecule compound
1-cyclopentyl-5-(difluoromethyl)-7-(4-ethylphenyl)-2-sulfanylpyrido[2,3-d]pyrimidin-4(1H)-one
Catalog ID
STL179225
SMILES CCc1ccc(cc1)c1cc(C(F)F)c2c(n1)n(C1CCCC1)c(nc2=O)S
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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 C21H21F2N3OS MW 401.48 g/mol Purity >90% as per NMR
InChI
InChI=1S/C21H21F2N3OS/c1-2-12-7-9-13(10-8-12)16-11-15(18(22)23)17-19(24-16)26(14-5-3-4-6-14)21(28)25-20(17)27/h7-11,14,18H,2-6H2,1H3,(H,25,27,28)InChIKey
FKMLXELKUWBKST-UHFFFAOYSA-NSynonyms
1011396-84-11011396841
1cyclopentyl5(difluoromethyl)7(4ethylphenyl)2sulfanylidenepyrido(23d)pyrimidin4one
1cyclopentyl5(difluoromethyl)7(4ethylphenyl)2sulfanylpyrido(23d)pyrimidin4(1H)one
CCC1=CC=C(C=C1)C2=NC3=C(C(=C2)C(F)F)C(=O)NC(=S)N3C4CCCC4
InChI=1SC21H21F2N3OSc12127913(10812)161115(18(22)23)1719(2416)26(14534614)21(28)2520(17)27h7111418H26H21H3(H252728)
MFCD09472581
ZINC000020603492
ZINC20603492
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