Vitas-M small molecule compound
2-(4-chlorophenyl)-7-(2-methylbutan-2-yl)-1,2,5,6,7,8-hexahydro[1]benzothieno[2,3-d]pyrimidin-4-ol
Catalog ID
STK386135
SMILES CCC(C1CCc2c(C1)sc1c2C(=NC(N1)c1ccc(cc1)Cl)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 C21H25ClN2OS MW 388.96 g/mol Purity >90% as per NMR
InChI
InChI=1S/C21H25ClN2OS/c1-4-21(2,3)13-7-10-15-16(11-13)26-20-17(15)19(25)23-18(24-20)12-5-8-14(22)9-6-12/h5-6,8-9,13,18,24H,4,7,10-11H2,1-3H3,(H,23,25)InChIKey
JJOQQUHOYUYFKE-UHFFFAOYSA-NSynonyms
2(4chlorophenyl)7(2methylbutan2yl)125678hexahydro(1)benzothieno(23d)pyrimidin4ol
2(4chlorophenyl)7(2methylbutan2yl)235678hexahydro1H(1)benzothiolo(23d)pyrimidin4one
CCC(C)(C)C1CCC2=C(C1)SC3=C2C(=O)NC(N3)C4=CC=C(C=C4)Cl
InChI=1SC21H25ClN2OSc1421(23)137101516(1113)262017(15)19(25)2318(2420)125814(22)9612h5689131824H471011H213H3(H2325)
MFCD03037279
ZINC000006655294
ZINC000006655310
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