Vitas-M small molecule compound
(5E)-2-(4-ethoxyphenyl)-5-(3-phenoxybenzylidene)[1,3]thiazolo[3,2-b][1,2,4]triazol-6(5H)-one
Catalog ID
STK810657
SMILES CCOc1ccc(cc1)c1nn2c(n1)s/c(=C/c1cccc(c1)Oc1ccccc1)/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 C25H19N3O3S MW 441.51 g/mol Purity >90% as per NMR
InChI
InChI=1S/C25H19N3O3S/c1-2-30-19-13-11-18(12-14-19)23-26-25-28(27-23)24(29)22(32-25)16-17-7-6-10-21(15-17)31-20-8-4-3-5-9-20/h3-16H,2H2,1H3/b22-16+InChIKey
ROOZCOBWHOVIBW-CJLVFECKSA-NSynonyms
(5E)2(4ETHOXYPHENYL)5((3PHENOXYPHENYL)METHYLIDENE)(13)THIAZOLO(32B)(124)TRIAZOL6ONE
(5E)2(4ethoxyphenyl)5(3phenoxybenzylidene)(13)thiazolo(32b)(124)triazol6(5H)one
CCOC1=CC=C(C=C1)C2=NN3C(=O)C(=CC4=CC(=CC=C4)OC5=CC=CC=C5)SC3=N2
CCOc1ccc(cc1)c1nn2c(n1)sc(=Cc1cccc(c1)Oc1ccccc1)c2=O
InChI=1SC25H19N3O3Sc123019131118(121419)23262528(2723)24(29)22(3225)1617761021(1517)31208435920h316H2H21H3b2216+
MFCD03933004
ZINC000028467537
ZINC28467537
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