Vitas-M small molecule compound
3-(5-tert-butyl-2-hydroxyphenyl)-6-methyl-2-sulfanylthieno[2,3-d]pyrimidin-4(3H)-one
Catalog ID
STK463141
SMILES Cc1sc2c(c1)c(=O)n(c(n2)S)c1cc(ccc1O)C(C)(C)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 C17H18N2O2S2 MW 346.47 g/mol Purity >90% as per NMR
InChI
InChI=1S/C17H18N2O2S2/c1-9-7-11-14(23-9)18-16(22)19(15(11)21)12-8-10(17(2,3)4)5-6-13(12)20/h5-8,20H,1-4H3,(H,18,22)InChIKey
JIYMXQHHBKPLMG-UHFFFAOYSA-NSynonyms
3(5(TERTBUTYL)2HYDROXYPHENYL)6METHYL2SULFANYL3HYDROTHIOPHENO(23D)PYRIMIDIN4ONE
3(5tertbutyl2hydroxyphenyl)6methyl2sulfanylidene1Hthieno(23d)pyrimidin4one
3(5tertbutyl2hydroxyphenyl)6methyl2sulfanylthieno(23d)pyrimidin4(3H)one
CC1=CC2=C(S1)NC(=S)N(C2=O)C3=C(C=CC(=C3)C(C)(C)C)O
InChI=1SC17H18N2O2S2c1971114(239)1816(22)19(15(11)21)12810(17(23)4)5613(12)20h5820H14H3(H1822)
MFCD06757613
ZINC000017072160
ZINC17072160
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