Vitas-M small molecule compound
2-(butan-2-ylsulfanyl)-5-(diphenylmethyl)-6-hydroxypyrimidin-4(3H)-one
Catalog ID
STK534702
SMILES CCC(Sc1nc(O)c(c(=O)[nH]1)C(c1ccccc1)c1ccccc1)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 C21H22N2O2S MW 366.48 g/mol Purity >90% as per NMR
InChI
InChI=1S/C21H22N2O2S/c1-3-14(2)26-21-22-19(24)18(20(25)23-21)17(15-10-6-4-7-11-15)16-12-8-5-9-13-16/h4-14,17H,3H2,1-2H3,(H2,22,23,24,25)InChIKey
JJZQZFSMBWLKBC-UHFFFAOYSA-NSynonyms
372975-10-52(butan2ylsulfanyl)5(diphenylmethyl)6hydroxypyrimidin4(3H)one
372975105
5benzhydryl2(secbutylthio)6hydroxypyrimidin4(3H)one
5BENZHYDRYL2BUTAN2YLSULFANYL4HYDROXY1HPYRIMIDIN6ONE
CCC(C)SC1=NC(=C(C(=O)N1)C(C2=CC=CC=C2)C3=CC=CC=C3)O
CCC(Sc1nc(O)c(c(=O)(nH)1)C(c1ccccc1)c1ccccc1)C
InChI=1SC21H22N2O2Sc1314(2)26212219(24)18(20(25)2321)17(15106471115)16128591316h41417H3H212H3(H222232425)
MFCD01953771
ZINC000013774639
ZINC000013774641
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