Vitas-M small molecule compound
2-(3-ethoxy-4-methoxyphenyl)-7-(propan-2-yl)-1,2,5,6,7,8-hexahydropyrido[4',3':4,5]thieno[2,3-d]pyrimidin-4-ol
Catalog ID
STK384392
SMILES CCOc1cc(ccc1OC)C1N=C(O)c2c(N1)sc1c2CCN(C1)C(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 C21H27N3O3S MW 401.53 g/mol Purity >90% as per NMR
InChI
InChI=1S/C21H27N3O3S/c1-5-27-16-10-13(6-7-15(16)26-4)19-22-20(25)18-14-8-9-24(12(2)3)11-17(14)28-21(18)23-19/h6-7,10,12,19,23H,5,8-9,11H2,1-4H3,(H,22,25)InChIKey
GPJKVCMAIPRVPT-UHFFFAOYSA-NSynonyms
2(3ethoxy4methoxyphenyl)7(propan2yl)125678hexahydropyrido(4345)thieno(23d)pyrimidin4ol
2(3ethoxy4methoxyphenyl)7propan2yl123568hexahydropyrido(23)thieno(24d)pyrimidin4one
CCOC1=C(C=CC(=C1)C2NC3=C(C4=C(S3)CN(CC4)C(C)C)C(=O)N2)OC
InChI=1SC21H27N3O3Sc1527161013(6715(16)264)192220(25)18148924(12(2)3)1117(14)2821(18)2319h6710121923H58911H214H3(H2225)
MFCD04041577
ZINC000004555331
ZINC000004555332
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