Vitas-M small molecule compound
3-(2-hydroxy-5-methylphenyl)-7-methyl-2-sulfanyl-5,6,7,8-tetrahydro[1]benzothieno[2,3-d]pyrimidin-4(3H)-one
Catalog ID
STK450422
SMILES CC1CCc2c(C1)sc1c2c(=O)n(c(n1)S)c1cc(C)ccc1O
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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 C18H18N2O2S2 MW 358.49 g/mol Purity >90% as per NMR
InChI
InChI=1S/C18H18N2O2S2/c1-9-4-6-13(21)12(7-9)20-17(22)15-11-5-3-10(2)8-14(11)24-16(15)19-18(20)23/h4,6-7,10,21H,3,5,8H2,1-2H3,(H,19,23)InChIKey
XSGHPRZFCRMUJE-UHFFFAOYSA-NSynonyms
3(2hydroxy5methylphenyl)7methyl2sulfanyl5678tetrahydro(1)benzothieno(23d)pyrimidin4(3H)one
3(2hydroxy5methylphenyl)7methyl2sulfanylidene5678tetrahydro1H(1)benzothiolo(23d)pyrimidin4one
CC1CCC2=C(C1)SC3=C2C(=O)N(C(=S)N3)C4=C(C=CC(=C4)C)O
InChI=1SC18H18N2O2S2c194613(21)12(79)2017(22)15115310(2)814(11)2416(15)1918(20)23h4671021H358H212H3(H1923)
MFCD06758160
ZINC000017074017
ZINC000017074018
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Check stock on Vitas-MAvailable files
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