Vitas-M small molecule compound
1-(2,2-dimethyltetrahydro-2H-pyran-4-yl)-4-(2-hydroxyquinolin-3-yl)-6-methyl-1,4-dihydropyrazolo[3,4-d][1,3]thiazin-3(2H)-one
Catalog ID
STL408650
SMILES CC1=Nc2c(C(S1)c1cc3ccccc3nc1O)c(=O)[nH]n2C1CCOC(C1)(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 C22H24N4O3S MW 424.52 g/mol Purity >90% as per NMR
InChI
InChI=1S/C22H24N4O3S/c1-12-23-19-17(21(28)25-26(19)14-8-9-29-22(2,3)11-14)18(30-12)15-10-13-6-4-5-7-16(13)24-20(15)27/h4-7,10,14,18H,8-9,11H2,1-3H3,(H,24,27)(H,25,28)InChIKey
AHURCWULXLONKY-UHFFFAOYSA-NSynonyms
1574324-53-01(22dimethyloxan4yl)6methyl4(2oxo1Hquinolin3yl)24dihydropyrazolo(34d)(13)thiazin3one
1(22dimethyltetrahydro2Hpyran4yl)4(2hydroxyquinolin3yl)6methyl14dihydropyrazolo(34d)(13)thiazin3(2H)one
1574324530
CC1=NC2=C(C(S1)C3=CC4=CC=CC=C4NC3=O)C(=O)NN2C5CCOC(C5)(C)C
CC1=Nc2c(C(S1)c1cc3ccccc3nc1O)c(=O)(nH)n2C1CCOC(C1)(C)C
InChI=1SC22H24N4O3Sc112231917(21(28)2526(19)14892922(23)1114)18(3012)151013645716(13)2420(15)27h47101418H8911H213H3(H2427)(H2528)
MFCD30705323
ZINC000096116832
ZINC000096116835
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