Vitas-M small molecule compound
(5Z)-5-[2-(hexyloxy)benzylidene]-2-[(E)-2-phenylethenyl][1,3]thiazolo[3,2-b][1,2,4]triazol-6(5H)-one
Catalog ID
STK800650
SMILES CCCCCCOc1ccccc1/C=c/1\sc2n(c1=O)nc(n2)/C=C/c1ccccc1
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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 C25H25N3O2S MW 431.56 g/mol Purity >90% as per NMR
InChI
InChI=1S/C25H25N3O2S/c1-2-3-4-10-17-30-21-14-9-8-13-20(21)18-22-24(29)28-25(31-22)26-23(27-28)16-15-19-11-6-5-7-12-19/h5-9,11-16,18H,2-4,10,17H2,1H3/b16-15+,22-18-InChIKey
AQHNXQOMHANPIT-BDNXVVLJSA-NSynonyms
(5Z)5((2hexoxyphenyl)methylidene)2((E)2phenylethenyl)(13)thiazolo(32b)(124)triazol6one
(5Z)5(2(hexyloxy)benzylidene)2((E)2phenylethenyl)(13)thiazolo(32b)(124)triazol6(5H)one
CCCCCCOC1=CC=CC=C1C=C2C(=O)N3C(=NC(=N3)C=CC4=CC=CC=C4)S2
CCCCCCOc1ccccc1C=c1sc2n(c1=O)nc(n2)C=Cc1ccccc1
InChI=1SC25H25N3O2Sc12341017302114981320(21)182224(29)2825(3122)2623(2728)161519116571219h59111618H241017H21H3b1615+2218
MFCD06642901
ZINC000016735834
ZINC16735834
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