Vitas-M small molecule compound
2-[(4-fluorobenzyl)sulfanyl]-4-hydroxy-5-(4-hydroxy-3-methoxyphenyl)-5,8-dihydropyrido[2,3-d]pyrimidin-7(6H)-one
Catalog ID
STK580703
SMILES COc1cc(ccc1O)C1CC(=O)Nc2c1c(O)nc(n2)SCc1ccc(cc1)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 C21H18FN3O4S MW 427.46 g/mol Purity >90% as per NMR
InChI
InChI=1S/C21H18FN3O4S/c1-29-16-8-12(4-7-15(16)26)14-9-17(27)23-19-18(14)20(28)25-21(24-19)30-10-11-2-5-13(22)6-3-11/h2-8,14,26H,9-10H2,1H3,(H2,23,24,25,27,28)InChIKey
FJFJEUHBNMKBFT-UHFFFAOYSA-NSynonyms
878433-11-52((4fluorobenzyl)sulfanyl)4hydroxy5(4hydroxy3methoxyphenyl)58dihydropyrido(23d)pyrimidin7(6H)one
2((4fluorophenyl)methylsulfanyl)5(4hydroxy3methoxyphenyl)1568tetrahydropyrido(23d)pyrimidine47dione
878433115
COC1=C(C=CC(=C1)C2CC(=O)NC3=C2C(=O)N=C(N3)SCC4=CC=C(C=C4)F)O
InChI=1SC21H18FN3O4Sc12916812(4715(16)26)14917(27)231918(14)20(28)2521(2419)3010112513(22)6311h281426H910H21H3(H22324252728)
MFCD07211966
ZINC000009187156
ZINC000013518402
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