Vitas-M small molecule compound
7-tert-butyl-2-(hexylsulfanyl)-3-(4-methoxyphenyl)-5,6,7,8-tetrahydro[1]benzothieno[2,3-d]pyrimidin-4(3H)-one
Catalog ID
STK996268
SMILES CCCCCCSc1nc2sc3c(c2c(=O)n1c1ccc(cc1)OC)CCC(C3)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 C27H36N2O2S2 MW 484.73 g/mol Purity >90% as per NMR
InChI
InChI=1S/C27H36N2O2S2/c1-6-7-8-9-16-32-26-28-24-23(21-15-10-18(27(2,3)4)17-22(21)33-24)25(30)29(26)19-11-13-20(31-5)14-12-19/h11-14,18H,6-10,15-17H2,1-5H3InChIKey
ZVCGFQXHBIXKCC-UHFFFAOYSA-NSynonyms
7tertbutyl2(hexylsulfanyl)3(4methoxyphenyl)5678tetrahydro(1)benzothieno(23d)pyrimidin4(3H)one
7tertbutyl2hexylsulfanyl3(4methoxyphenyl)5678tetrahydro(1)benzothiolo(23d)pyrimidin4one
CCCCCCSC1=NC2=C(C3=C(S2)CC(CC3)C(C)(C)C)C(=O)N1C4=CC=C(C=C4)OC
InChI=1SC27H36N2O2S2c16789163226282423(21151018(27(23)4)1722(21)3324)25(30)29(26)19111320(315)141219h111418H6101517H215H3
MFCD02631124
ZINC000008432057
ZINC000008432058
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