Vitas-M small molecule compound
1-(2,2-dimethyltetrahydro-2H-pyran-4-yl)-4-(2-hydroxy-7-methoxyquinolin-3-yl)-6-methyl-1,4-dihydropyrazolo[3,4-d][1,3]thiazin-3(2H)-one
Catalog ID
STL312027
SMILES COc1ccc2c(c1)nc(c(c2)C1SC(=Nc2c1c(=O)[nH]n2C1CCOC(C1)(C)C)C)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 C23H26N4O4S MW 454.55 g/mol Purity >90% as per NMR
InChI
InChI=1S/C23H26N4O4S/c1-12-24-20-18(22(29)26-27(20)14-7-8-31-23(2,3)11-14)19(32-12)16-9-13-5-6-15(30-4)10-17(13)25-21(16)28/h5-6,9-10,14,19H,7-8,11H2,1-4H3,(H,25,28)(H,26,29)InChIKey
BKEHFQLCTYRNQS-UHFFFAOYSA-NSynonyms
1574365-76-61(22dimethyloxan4yl)4(7methoxy2oxo1Hquinolin3yl)6methyl24dihydropyrazolo(34d)(13)thiazin3one
1(22dimethyltetrahydro2Hpyran4yl)4(2hydroxy7methoxyquinolin3yl)6methyl14dihydropyrazolo(34d)(13)thiazin3(2H)one
1574365766
CC1=NC2=C(C(S1)C3=CC4=C(C=C(C=C4)OC)NC3=O)C(=O)NN2C5CCOC(C5)(C)C
COc1ccc2c(c1)nc(c(c2)C1SC(=Nc2c1c(=O)(nH)n2C1CCOC(C1)(C)C)C)O
InChI=1SC23H26N4O4Sc112242018(22(29)2627(20)14783123(23)1114)19(3212)169135615(304)1017(13)2521(16)28h569101419H7811H214H3(H2528)(H2629)
MFCD28026430
ZINC000095474470
ZINC000095474473
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