Vitas-M small molecule compound
2-(4,7-dimethoxy-1,3-benzodioxol-5-yl)-9-(methoxymethyl)-7-methyl-2,3-dihydropyrido[3',2':4,5]thieno[3,2-d]pyrimidin-4(1H)-one
Catalog ID
STL434501
SMILES COCc1cc(C)nc2c1c1NC(NC(=O)c1s2)c1cc(OC)c2c(c1OC)OCO2
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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 C21H21N3O6S MW 443.48 g/mol Purity >90% as per NMR
InChI
InChI=1S/C21H21N3O6S/c1-9-5-10(7-26-2)13-14-18(31-21(13)22-9)20(25)24-19(23-14)11-6-12(27-3)16-17(15(11)28-4)30-8-29-16/h5-6,19,23H,7-8H2,1-4H3,(H,24,25)InChIKey
WCNVUMHPOZRVHC-UHFFFAOYSA-NSynonyms
2(47dimethoxy13benzodioxol5yl)9(methoxymethyl)7methyl23dihydro1Hpyrido(12)thieno(34d)pyrimidin4one
2(47dimethoxy13benzodioxol5yl)9(methoxymethyl)7methyl23dihydropyrido(3245)thieno(32d)pyrimidin4(1H)one
CC1=NC2=C(C(=C1)COC)C3=C(S2)C(=O)NC(N3)C4=CC(=C5C(=C4OC)OCO5)OC
InChI=1SC21H21N3O6Sc19510(7262)131418(3121(13)229)20(25)2419(2314)11612(273)1617(15(11)284)3082916h561923H78H214H3(H2425)
MFCD30711157
ZINC000096335738
ZINC000096335739
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