Vitas-M small molecule compound
1-cycloheptyl-4-(3,4-dihydroxyphenyl)-6-methyl-1,4-dihydropyrazolo[3,4-d][1,3]thiazin-3(2H)-one
Catalog ID
STL434243
SMILES CC1=Nc2c(C(S1)c1ccc(c(c1)O)O)c(=O)[nH]n2C1CCCCCC1
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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 C19H23N3O3S MW 373.48 g/mol Purity >90% as per NMR
InChI
InChI=1S/C19H23N3O3S/c1-11-20-18-16(17(26-11)12-8-9-14(23)15(24)10-12)19(25)21-22(18)13-6-4-2-3-5-7-13/h8-10,13,17,23-24H,2-7H2,1H3,(H,21,25)InChIKey
GGKYSRACSNZUSN-UHFFFAOYSA-NSynonyms
1cycloheptyl4(34dihydroxyphenyl)6methyl14dihydropyrazolo(34d)(13)thiazin3(2H)one
1cycloheptyl4(34dihydroxyphenyl)6methyl24dihydropyrazolo(34d)(13)thiazin3one
CC1=NC2=C(C(S1)C3=CC(=C(C=C3)O)O)C(=O)NN2C4CCCCCC4
CC1=Nc2c(C(S1)c1ccc(c(c1)O)O)c(=O)(nH)n2C1CCCCCC1
InChI=1SC19H23N3O3Sc111201816(17(2611)128914(23)15(24)1012)19(25)2122(18)1364235713h81013172324H27H21H3(H2125)
MFCD26098667
ZINC000085412261
ZINC000085412264
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