Vitas-M small molecule compound
1-(2,2-dimethyltetrahydro-2H-pyran-4-yl)-4-(4-hydroxy-3,5-dimethoxyphenyl)-6-methyl-1,4-dihydropyrazolo[3,4-d][1,3]thiazin-3-ol
Catalog ID
STL407439
SMILES COc1cc(cc(c1O)OC)C1SC(=Nc2c1c(O)nn2C1CCOC(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 C21H27N3O5S MW 433.53 g/mol Purity >90% as per NMR
InChI
InChI=1S/C21H27N3O5S/c1-11-22-19-16(20(26)23-24(19)13-6-7-29-21(2,3)10-13)18(30-11)12-8-14(27-4)17(25)15(9-12)28-5/h8-9,13,18,25H,6-7,10H2,1-5H3,(H,23,26)InChIKey
DNDPYEHOIXWJFG-UHFFFAOYSA-NSynonyms
1574319-86-01(22dimethyloxan4yl)4(4hydroxy35dimethoxyphenyl)6methyl24dihydropyrazolo(34d)(13)thiazin3one
1(22dimethyltetrahydro2Hpyran4yl)4(4hydroxy35dimethoxyphenyl)6methyl14dihydropyrazolo(34d)(13)thiazin3ol
1574319860
CC1=NC2=C(C(S1)C3=CC(=C(C(=C3)OC)O)OC)C(=O)NN2C4CCOC(C4)(C)C
InChI=1SC21H27N3O5Sc111221916(20(26)2324(19)13672921(23)1013)18(3011)12814(274)17(25)15(912)285h89131825H6710H215H3(H2326)
MFCD30704740
ZINC000096117731
ZINC000096117734
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