Vitas-M small molecule compound
(5Z)-5-[(2-methyl-2H-chromen-3-yl)methylidene]-2-[4-(pentyloxy)phenyl][1,3]thiazolo[3,2-b][1,2,4]triazol-6(5H)-one
Catalog ID
STK817882
SMILES CCCCCOc1ccc(cc1)c1nn2c(n1)s/c(=C\C1=Cc3ccccc3OC1C)/c2=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 C26H25N3O3S MW 459.57 g/mol Purity >90% as per NMR
InChI
InChI=1S/C26H25N3O3S/c1-3-4-7-14-31-21-12-10-18(11-13-21)24-27-26-29(28-24)25(30)23(33-26)16-20-15-19-8-5-6-9-22(19)32-17(20)2/h5-6,8-13,15-17H,3-4,7,14H2,1-2H3/b23-16-InChIKey
JQLUONDUVWVSQZ-KQWNVCNZSA-NSynonyms
(5Z)5((2methyl2Hchromen3yl)methylidene)2(4(pentyloxy)phenyl)(13)thiazolo(32b)(124)triazol6(5H)one
(5Z)5((2METHYL2HCHROMEN3YL)METHYLIDENE)2(4PENTOXYPHENYL)(13)THIAZOLO(32B)(124)TRIAZOL6ONE
CCCCCOC1=CC=C(C=C1)C2=NN3C(=O)C(=CC4=CC5=CC=CC=C5OC4C)SC3=N2
CCCCCOc1ccc(cc1)c1nn2c(n1)sc(=CC1=Cc3ccccc3OC1C)c2=O
InChI=1SC26H25N3O3Sc1347143121121018(111321)24272629(2824)25(30)23(3326)16201519856922(19)3217(20)2h568131517H34714H212H3b2316
MFCD06643031
ZINC000003650948
ZINC000003650951
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