Vitas-M small molecule compound
4-(1-cyclohexyl-3-hydroxy-6-methyl-1,4-dihydropyrazolo[3,4-d][1,3]thiazin-4-yl)benzoic acid
Catalog ID
STL247040
SMILES CC1=Nc2c(C(S1)c1ccc(cc1)C(=O)O)c(nn2C1CCCCC1)O
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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 C19H21N3O3S MW 371.46 g/mol Purity >90% as per NMR
InChI
InChI=1S/C19H21N3O3S/c1-11-20-17-15(18(23)21-22(17)14-5-3-2-4-6-14)16(26-11)12-7-9-13(10-8-12)19(24)25/h7-10,14,16H,2-6H2,1H3,(H,21,23)(H,24,25)InChIKey
UUEBKYPCBGCVRL-UHFFFAOYSA-NSynonyms
1324060-55-01324060550
4(1cyclohexyl3hydroxy6methyl14dihydropyrazolo(34d)(13)thiazin4yl)benzoicacid
4(1cyclohexyl6methyl3oxo24dihydropyrazolo(34d)(13)thiazin4yl)benzoicacid
CC1=NC2=C(C(S1)C3=CC=C(C=C3)C(=O)O)C(=O)NN2C4CCCCC4
InChI=1SC19H21N3O3Sc111201715(18(23)2122(17)145324614)16(2611)127913(10812)19(24)25h7101416H26H21H3(H2123)(H2425)
MFCD24860758
ZINC000071286487
ZINC000071286489
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