Vitas-M small molecule compound
2-[4-(benzyloxy)-3-methoxyphenyl]-7-(2-methylbutan-2-yl)-1,2,5,6,7,8-hexahydro[1]benzothieno[2,3-d]pyrimidin-4-ol
Catalog ID
STK383870
SMILES CCC(C1CCc2c(C1)sc1c2C(=NC(N1)c1ccc(c(c1)OC)OCc1ccccc1)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 C29H34N2O3S MW 490.67 g/mol Purity >90% as per NMR
InChI
InChI=1S/C29H34N2O3S/c1-5-29(2,3)20-12-13-21-24(16-20)35-28-25(21)27(32)30-26(31-28)19-11-14-22(23(15-19)33-4)34-17-18-9-7-6-8-10-18/h6-11,14-15,20,26,31H,5,12-13,16-17H2,1-4H3,(H,30,32)InChIKey
HDIJGHQJURBOCL-UHFFFAOYSA-NSynonyms
2(3methoxy4phenylmethoxyphenyl)7(2methylbutan2yl)235678hexahydro1H(1)benzothiolo(23d)pyrimidin4one
2(4(benzyloxy)3methoxyphenyl)7(2methylbutan2yl)125678hexahydro(1)benzothieno(23d)pyrimidin4ol
CCC(C)(C)C1CCC2=C(C1)SC3=C2C(=O)NC(N3)C4=CC(=C(C=C4)OCC5=CC=CC=C5)OC
InChI=1SC29H34N2O3Sc1529(23)2012132124(1620)352825(21)27(32)3026(3128)19111422(23(1519)334)34171897681018h6111415202631H512131617H214H3(H3032)
MFCD03848758
ZINC000008919888
ZINC000008919901
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