Vitas-M small molecule compound
6-hydroxy-5-(4-methylbenzyl)-2-thioxo-2,3-dihydropyrimidin-4(1H)-one
Catalog ID
STK299167
SMILES Cc1ccc(cc1)Cc1c(O)[nH]c(=S)[nH]c1=O
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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 C12H12N2O2S MW 248.31 g/mol Purity >90% as per NMR
InChI
InChI=1S/C12H12N2O2S/c1-7-2-4-8(5-3-7)6-9-10(15)13-12(17)14-11(9)16/h2-5H,6H2,1H3,(H3,13,14,15,16,17)InChIKey
XVWPHZIYGPVPFQ-UHFFFAOYSA-NSynonyms
6hydroxy5((4methylphenyl)methyl)2sulfanylidene1Hpyrimidin4one
6hydroxy5(4methylbenzyl)2thioxo23dihydropyrimidin4(1H)one
CC1=CC=C(C=C1)CC2=C(NC(=S)NC2=O)O
Cc1ccc(cc1)Cc1c(O)(nH)c(=S)(nH)c1=O
InChI=1SC12H12N2O2Sc17248(537)6910(15)1312(17)1411(9)16h25H6H21H3(H31314151617)
MFCD09961273
ZINC000013957350
ZINC13957350
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