Vitas-M small molecule compound
4-[4-hydroxy-7-(2-methylbutan-2-yl)-1,2,5,6,7,8-hexahydro[1]benzothieno[2,3-d]pyrimidin-2-yl]-2-methoxyphenyl 4-methoxybenzoate
Catalog ID
STK383976
SMILES CCC(C1CCc2c(C1)sc1c2C(=NC(N1)c1ccc(c(c1)OC)OC(=O)c1ccc(cc1)OC)O)(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 C30H34N2O5S MW 534.68 g/mol Purity >90% as per NMR
InChI
InChI=1S/C30H34N2O5S/c1-6-30(2,3)19-10-13-21-24(16-19)38-28-25(21)27(33)31-26(32-28)18-9-14-22(23(15-18)36-5)37-29(34)17-7-11-20(35-4)12-8-17/h7-9,11-12,14-15,19,26,32H,6,10,13,16H2,1-5H3,(H,31,33)InChIKey
MFEOALQNPRIZOZ-UHFFFAOYSA-NSynonyms
(2methoxy4(7(2methylbutan2yl)4oxo235678hexahydro1H(1)benzothiolo(23d)pyrimidin2yl)phenyl)4methoxybenzoate
4(4hydroxy7(2methylbutan2yl)125678hexahydro(1)benzothieno(23d)pyrimidin2yl)2methoxyphenyl4methoxybenzoate
CCC(C)(C)C1CCC2=C(C1)SC3=C2C(=O)NC(N3)C4=CC(=C(C=C4)OC(=O)C5=CC=C(C=C5)OC)OC
InChI=1SC30H34N2O5Sc1630(23)1910132124(1619)382825(21)27(33)3126(3228)1891422(23(1518)365)3729(34)1771120(354)12817h7911121415192632H6101316H215H3(H3133)
MFCD03837050
ZINC000102092985
ZINC000102093000
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