Vitas-M small molecule compound

4-(6-chloro-4H-1,3-benzodioxin-8-yl)-1-(2,2-dimethyltetrahydro-2H-pyran-4-yl)-6-methyl-1,4-dihydropyrazolo[3,4-d][1,3]thiazin-3-ol

Catalog ID
STL407339
SMILES Clc1cc(C2SC(=Nc3c2c(O)nn3C2CCOC(C2)(C)C)C)c2c(c1)COCO2

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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 C21H24ClN3O4S MW 449.96 g/mol Purity >90% as per NMR
InChI
InChI=1S/C21H24ClN3O4S/c1-11-23-19-16(20(26)24-25(19)14-4-5-29-21(2,3)8-14)18(30-11)15-7-13(22)6-12-9-27-10-28-17(12)15/h6-7,14,18H,4-5,8-10H2,1-3H3,(H,24,26)
InChIKey
NZFNCZMJHHAUTC-UHFFFAOYSA-N
Synonyms
1574463-76-5
1574463765
4(6chloro4H13benzodioxin8yl)1(22dimethyloxan4yl)6methyl24dihydropyrazolo(34d)(13)thiazin3one
4(6chloro4H13benzodioxin8yl)1(22dimethyltetrahydro2Hpyran4yl)6methyl14dihydropyrazolo(34d)(13)thiazin3ol
CC1=NC2=C(C(S1)C3=C4C(=CC(=C3)Cl)COCO4)C(=O)NN2C5CCOC(C5)(C)C
InChI=1SC21H24ClN3O4Sc111231916(20(26)2425(19)14452921(23)814)18(3011)15713(22)612927102817(12)15h671418H45810H213H3(H2426)
MFCD30704693
ZINC000096116681
ZINC000096116684

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Available files

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