Vitas-M small molecule compound
1-cyclohexyl-4-[4-methoxy-3-(propan-2-yloxy)phenyl]-6-methyl-1,4-dihydropyrazolo[3,4-d][1,3]thiazin-3(2H)-one
Catalog ID
STL434340
SMILES COc1ccc(cc1OC(C)C)C1SC(=Nc2c1c(=O)[nH]n2C1CCCCC1)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 C22H29N3O3S MW 415.56 g/mol Purity >90% as per NMR
InChI
InChI=1S/C22H29N3O3S/c1-13(2)28-18-12-15(10-11-17(18)27-4)20-19-21(23-14(3)29-20)25(24-22(19)26)16-8-6-5-7-9-16/h10-13,16,20H,5-9H2,1-4H3,(H,24,26)InChIKey
QVIHIQJQMDOQBK-UHFFFAOYSA-NSynonyms
1cyclohexyl4(4methoxy3(propan2yloxy)phenyl)6methyl14dihydropyrazolo(34d)(13)thiazin3(2H)one
1cyclohexyl4(4methoxy3propan2yloxyphenyl)6methyl24dihydropyrazolo(34d)(13)thiazin3one
CC1=NC2=C(C(S1)C3=CC(=C(C=C3)OC)OC(C)C)C(=O)NN2C4CCCCC4
COc1ccc(cc1OC(C)C)C1SC(=Nc2c1c(=O)(nH)n2C1CCCCC1)C
InChI=1SC22H29N3O3Sc113(2)28181215(101117(18)274)201921(2314(3)2920)25(2422(19)26)168657916h10131620H59H214H3(H2426)
MFCD26098754
ZINC000085412754
ZINC000085412759
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