Vitas-M small molecule compound
6-butyl-3-(2-methyl-1,3-thiazol-4-yl)-4-oxo-4H-chromen-7-yl D-valinate
Catalog ID
STL525173
SMILES CCCCc1cc2c(cc1OC(=O)[C@@H](C(C)C)N)occ(c2=O)c1csc(n1)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 C22H26N2O4S MW 414.53 g/mol Purity >90% as per NMR
InChI
InChI=1S/C22H26N2O4S/c1-5-6-7-14-8-15-19(9-18(14)28-22(26)20(23)12(2)3)27-10-16(21(15)25)17-11-29-13(4)24-17/h8-12,20H,5-7,23H2,1-4H3/t20-/m1/s1InChIKey
CCMNXZDPGMXAKQ-HXUWFJFHSA-NSynonyms
(6butyl3(2methyl13thiazol4yl)4oxochromen7yl)(2~(R))2amino3methylbutanoate
(6BUTYL3(2METHYL13THIAZOL4YL)4OXOCHROMEN7YL)(2R)2AMINO3METHYLBUTANOATE
(R)6butyl3(2methylthiazol4yl)4oxo4Hchromen7yl2amino3methylbutanoatedihydrochloride
1605852
6butyl3(2methyl13thiazol4yl)4oxo4Hchromen7ylDvalinate
CCCCc1cc2c(cc1OC(=O)(C@@H)(C(C)C)N)occ(c2=O)c1csc(n1)CClCl
InChI=1SC22H26N2O4Sc15671481519(918(14)2822(26)20(23)12(2)3)271016(21(15)25)17112913(4)2417h81220H5723H214H3t20m1s1
MFCD01082980
ZINC000020111224
ZINC20111224
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