Vitas-M small molecule compound
7-tert-butyl-2-(2-methoxynaphthalen-1-yl)-1,2,5,6,7,8-hexahydro[1]benzothieno[2,3-d]pyrimidin-4-ol
Catalog ID
STK213656
SMILES COc1ccc2c(c1C1N=C(O)c3c(N1)sc1c3CCC(C1)C(C)(C)C)cccc2
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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 C25H28N2O2S MW 420.58 g/mol Purity >90% as per NMR
InChI
InChI=1S/C25H28N2O2S/c1-25(2,3)15-10-11-17-19(13-15)30-24-21(17)23(28)26-22(27-24)20-16-8-6-5-7-14(16)9-12-18(20)29-4/h5-9,12,15,22,27H,10-11,13H2,1-4H3,(H,26,28)InChIKey
JZKPOVKCXXICMA-UHFFFAOYSA-NSynonyms
7tertbutyl2(2methoxynaphthalen1yl)125678hexahydro(1)benzothieno(23d)pyrimidin4ol
7tertbutyl2(2methoxynaphthalen1yl)235678hexahydro1H(1)benzothiolo(23d)pyrimidin4one
CC(C)(C)C1CCC2=C(C1)SC3=C2C(=O)NC(N3)C4=C(C=CC5=CC=CC=C54)OC
InChI=1SC25H28N2O2Sc125(23)1510111719(1315)302421(17)23(28)2622(2724)2016865714(16)91218(20)294h5912152227H101113H214H3(H2628)
MFCD07436931
ZINC000004783900
ZINC000004783905
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