Vitas-M small molecule compound
(5E)-5-(4-butoxybenzylidene)-2-phenyl[1,3]thiazolo[3,2-b][1,2,4]triazol-6(5H)-one
Catalog ID
STK797255
SMILES CCCCOc1ccc(cc1)/C=c\1/sc2n(c1=O)nc(n2)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 C21H19N3O2S MW 377.47 g/mol Purity >90% as per NMR
InChI
InChI=1S/C21H19N3O2S/c1-2-3-13-26-17-11-9-15(10-12-17)14-18-20(25)24-21(27-18)22-19(23-24)16-7-5-4-6-8-16/h4-12,14H,2-3,13H2,1H3/b18-14+InChIKey
PSUHXKDNVGBAOK-NBVRZTHBSA-NSynonyms
(5E)5((4BUTOXYPHENYL)METHYLIDENE)2PHENYL(13)THIAZOLO(32B)(124)TRIAZOL6ONE
(5E)5(4butoxybenzylidene)2phenyl(13)thiazolo(32b)(124)triazol6(5H)one
(Z)5(4butoxybenzylidene)2phenylthiazolo(32b)(124)triazol6(5H)one
CCCCOC1=CC=C(C=C1)C=C2C(=O)N3C(=NC(=N3)C4=CC=CC=C4)S2
CCCCOc1ccc(cc1)C=c1sc2n(c1=O)nc(n2)c1ccccc1
InChI=1SC21H19N3O2Sc12313261711915(101217)141820(25)2421(2718)2219(2324)167546816h41214H2313H21H3b1814+
MFCD03225917
ZINC000002305834
ZINC02305834
ZINC2305834
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