Vitas-M small molecule compound

(5Z)-5-[4-(benzyloxy)-3-methoxybenzylidene]-2-(4-methoxyphenyl)[1,3]thiazolo[3,2-b][1,2,4]triazol-6(5H)-one

Catalog ID
STK812203
SMILES COc1cc(ccc1OCc1ccccc1)/C=c/1\sc2n(c1=O)nc(n2)c1ccc(cc1)OC

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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 C26H21N3O4S MW 471.54 g/mol Purity >90% as per NMR
InChI
InChI=1S/C26H21N3O4S/c1-31-20-11-9-19(10-12-20)24-27-26-29(28-24)25(30)23(34-26)15-18-8-13-21(22(14-18)32-2)33-16-17-6-4-3-5-7-17/h3-15H,16H2,1-2H3/b23-15-
InChIKey
BQOCUVZBRIXPKV-HAHDFKILSA-N
Synonyms

(5Z)2(4METHOXYPHENYL)5((3METHOXY4PHENYLMETHOXYPHENYL)METHYLIDENE)(13)THIAZOLO(32B)(124)TRIAZOL6ONE
(5Z)5(4(benzyloxy)3methoxybenzylidene)2(4methoxyphenyl)(13)thiazolo(32b)(124)triazol6(5H)one
5((4(BENZYLOXY)3METHOXYPHENYL)METHYLIDENE)2(4METHOXYPHENYL)5H6H(124)TRIAZOLO(32B)(13)THIAZOL6ONE
COC1=CC=C(C=C1)C2=NN3C(=O)C(=CC4=CC(=C(C=C4)OCC5=CC=CC=C5)OC)SC3=N2
COc1cc(ccc1OCc1ccccc1)C=c1sc2n(c1=O)nc(n2)c1ccc(cc1)OC
InChI=1SC26H21N3O4Sc1312011919(101220)24272629(2824)25(30)23(3426)151881321(22(1418)322)3316176435717h315H16H212H3b2315
MFCD03533139
ZINC000016728764
ZINC16728764

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Available files

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