Vitas-M small molecule compound
7-tert-butyl-2-(2-hydroxy-5-methylphenyl)-1,2,5,6,7,8-hexahydro[1]benzothieno[2,3-d]pyrimidin-4-ol
Catalog ID
STL456215
SMILES Cc1ccc(c(c1)C1N=C(O)c2c(N1)sc1c2CCC(C1)C(C)(C)C)O
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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 C21H26N2O2S MW 370.52 g/mol Purity >90% as per NMR
InChI
InChI=1S/C21H26N2O2S/c1-11-5-8-15(24)14(9-11)18-22-19(25)17-13-7-6-12(21(2,3)4)10-16(13)26-20(17)23-18/h5,8-9,12,18,23-24H,6-7,10H2,1-4H3,(H,22,25)InChIKey
REGZUWSLUWBQAB-UHFFFAOYSA-NSynonyms
7tertbutyl2(2hydroxy5methylphenyl)125678hexahydro(1)benzothieno(23d)pyrimidin4ol
7tertbutyl2(2hydroxy5methylphenyl)235678hexahydro1H(1)benzothiolo(23d)pyrimidin4one
CC1=CC(=C(C=C1)O)C2NC3=C(C4=C(S3)CC(CC4)C(C)(C)C)C(=O)N2
InChI=1SC21H26N2O2Sc1115815(24)14(911)182219(25)17137612(21(23)4)1016(13)2620(17)2318h58912182324H6710H214H3(H2225)
MFCD07773799
ZINC000005274728
ZINC000005274731
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