Vitas-M small molecule compound
4-(1-cyclopentyl-3-hydroxy-6-methyl-1,4-dihydropyrazolo[3,4-d][1,3]thiazin-4-yl)benzoic acid
Catalog ID
STL243536
SMILES CC1=Nc2c(C(S1)c1ccc(cc1)C(=O)O)c(nn2C1CCCC1)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 C18H19N3O3S MW 357.43 g/mol Purity >90% as per NMR
InChI
InChI=1S/C18H19N3O3S/c1-10-19-16-14(17(22)20-21(16)13-4-2-3-5-13)15(25-10)11-6-8-12(9-7-11)18(23)24/h6-9,13,15H,2-5H2,1H3,(H,20,22)(H,23,24)InChIKey
KUJHIQCSMKNAKM-UHFFFAOYSA-NSynonyms
1324093-49-31324093493
4(1cyclopentyl3hydroxy6methyl14dihydropyrazolo(34d)(13)thiazin4yl)benzoicacid
4(1cyclopentyl6methyl3oxo24dihydropyrazolo(34d)(13)thiazin4yl)benzoicacid
CC1=NC2=C(C(S1)C3=CC=C(C=C3)C(=O)O)C(=O)NN2C4CCCC4
InChI=1SC18H19N3O3Sc110191614(17(22)2021(16)13423513)15(2510)116812(9711)18(23)24h691315H25H21H3(H2022)(H2324)
MFCD24859666
ZINC000071285608
ZINC000071285609
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