Vitas-M small molecule compound
2-(1,2-dimethyl-1H-indol-3-yl)-7-(2-methylbutan-2-yl)-1,2,5,6,7,8-hexahydro[1]benzothieno[2,3-d]pyrimidin-4-ol
Catalog ID
STK383231
SMILES CCC(C1CCc2c(C1)sc1c2C(=NC(N1)c1c(C)n(c2c1cccc2)C)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 C25H31N3OS MW 421.61 g/mol Purity >90% as per NMR
InChI
InChI=1S/C25H31N3OS/c1-6-25(3,4)15-11-12-17-19(13-15)30-24-21(17)23(29)26-22(27-24)20-14(2)28(5)18-10-8-7-9-16(18)20/h7-10,15,22,27H,6,11-13H2,1-5H3,(H,26,29)InChIKey
ZLRQUDPTRBTIHB-UHFFFAOYSA-NSynonyms
2(12dimethyl1Hindol3yl)7(2methylbutan2yl)125678hexahydro(1)benzothieno(23d)pyrimidin4ol
2(12dimethylindol3yl)7(2methylbutan2yl)235678hexahydro1H(1)benzothiolo(23d)pyrimidin4one
CCC(C)(C)C1CCC2=C(C1)SC3=C2C(=O)NC(N3)C4=C(N(C5=CC=CC=C54)C)C
InChI=1SC25H31N3OSc1625(34)1511121719(1315)302421(17)23(29)2622(2724)2014(2)28(5)181087916(18)20h710152227H61113H215H3(H2629)
MFCD03103584
ZINC000006709524
ZINC000006709537
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