Vitas-M small molecule compound
(5Z)-5-(2H-chromen-3-ylmethylidene)-2-[4-(hexyloxy)phenyl][1,3]thiazolo[3,2-b][1,2,4]triazol-6(5H)-one
Catalog ID
STK818520
SMILES CCCCCCOc1ccc(cc1)c1nn2c(n1)s/c(=C\C1=Cc3c(OC1)cccc3)/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/c1-2-3-4-7-14-31-21-12-10-19(11-13-21)24-27-26-29(28-24)25(30)23(33-26)16-18-15-20-8-5-6-9-22(20)32-17-18/h5-6,8-13,15-16H,2-4,7,14,17H2,1H3/b23-16-InChIKey
VBLCPZOFRIHOJK-KQWNVCNZSA-NSynonyms
(5Z)5(2Hchromen3ylmethylidene)2(4(hexyloxy)phenyl)(13)thiazolo(32b)(124)triazol6(5H)one
(5Z)5(2HCHROMEN3YLMETHYLIDENE)2(4HEXOXYPHENYL)(13)THIAZOLO(32B)(124)TRIAZOL6ONE
CCCCCCOC1=CC=C(C=C1)C2=NN3C(=O)C(=CC4=CC5=CC=CC=C5OC4)SC3=N2
CCCCCCOc1ccc(cc1)c1nn2c(n1)sc(=CC1=Cc3c(OC1)cccc3)c2=O
InChI=1SC26H25N3O3Sc12347143121121019(111321)24272629(2824)25(30)23(3326)16181520856922(20)321718h568131516H2471417H21H3b2316
MFCD06643106
ZINC000003651037
ZINC03651037
ZINC3651037
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