Vitas-M small molecule compound
3-(2-methoxybenzyl)-2-sulfanyl-5,6,7,8-tetrahydro[1]benzothieno[2,3-d]pyrimidin-4(3H)-one
Catalog ID
STK436609
SMILES COc1ccccc1Cn1c(S)nc2c(c1=O)c1CCCCc1s2
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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/c1-22-13-8-4-2-6-11(13)10-20-17(21)15-12-7-3-5-9-14(12)24-16(15)19-18(20)23/h2,4,6,8H,3,5,7,9-10H2,1H3,(H,19,23)InChIKey
GJRGIXXWTPNCQN-UHFFFAOYSA-NSynonyms
3((2methoxyphenyl)methyl)2sulfanylidene5678tetrahydro1H(1)benzothiolo(23d)pyrimidin4one
3(2methoxybenzyl)2sulfanyl5678tetrahydro(1)benzothieno(23d)pyrimidin4(3H)one
COC1=CC=CC=C1CN2C(=O)C3=C(NC2=S)SC4=C3CCCC4
InChI=1SC18H18N2O2S2c12213842611(13)102017(21)1512735914(12)2416(15)1918(20)23h2468H357910H21H3(H1923)
MFCD03944762
ZINC000006420421
ZINC06420421
ZINC6420421
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