Vitas-M small molecule compound
2-(benzylsulfanyl)-5-hexyl-6-hydroxypyrimidin-4(3H)-one
Catalog ID
STK865115
SMILES CCCCCCc1c(O)nc([nH]c1=O)SCc1ccccc1
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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 C17H22N2O2S MW 318.44 g/mol Purity >90% as per NMR
InChI
InChI=1S/C17H22N2O2S/c1-2-3-4-8-11-14-15(20)18-17(19-16(14)21)22-12-13-9-6-5-7-10-13/h5-7,9-10H,2-4,8,11-12H2,1H3,(H2,18,19,20,21)InChIKey
XKMHGSJQFQDQDH-UHFFFAOYSA-NSynonyms
439131-89-22(BENZYLSULFANYL)5HEXYL6HYDROXY4(3H)PYRIMIDINONE
2(benzylsulfanyl)5hexyl6hydroxypyrimidin4(3H)one
2(benzylthio)5hexyl6hydroxypyrimidin4(3H)one
2BENZYLSULFANYL5HEXYL4HYDROXY1HPYRIMIDIN6ONE
2BENZYLTHIO5HEXYL6HYDROXY3HPYRIMIDIN4ONE
439131892
5HEXYL6HYDROXY2(PHENYLMETHYLTHIO)3HYDROPYRIMIDIN4ONE
CCCCCCC1=C(N=C(NC1=O)SCC2=CC=CC=C2)O
CCCCCCc1c(O)nc((nH)c1=O)SCc1ccccc1
InChI=1SC17H22N2O2Sc12348111415(20)1817(1916(14)21)22121396571013h57910H2481112H21H3(H218192021)
MFCD02927737
ZINC000013552951
ZINC13552951
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