Vitas-M small molecule compound
(5E)-5-(2-butoxybenzylidene)-2-(4-chlorophenyl)[1,3]thiazolo[3,2-b][1,2,4]triazol-6(5H)-one
Catalog ID
STK812591
SMILES CCCCOc1ccccc1/C=c\1/sc2n(c1=O)nc(n2)c1ccc(cc1)Cl
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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 C21H18ClN3O2S MW 411.91 g/mol Purity >90% as per NMR
InChI
InChI=1S/C21H18ClN3O2S/c1-2-3-12-27-17-7-5-4-6-15(17)13-18-20(26)25-21(28-18)23-19(24-25)14-8-10-16(22)11-9-14/h4-11,13H,2-3,12H2,1H3/b18-13+InChIKey
BWCNVBSALPWSNB-QGOAFFKASA-NSynonyms
616210-40-3(5E)5((2BUTOXYPHENYL)METHYLIDENE)2(4CHLOROPHENYL)(13)THIAZOLO(32B)(124)TRIAZOL6ONE
(5E)5(2butoxybenzylidene)2(4chlorophenyl)(13)thiazolo(32b)(124)triazol6(5H)one
(E)5(2butoxybenzylidene)2(4chlorophenyl)thiazolo(32b)(124)triazol6(5H)one
5((2BUTOXYPHENYL)METHYLIDENE)2(4CHLOROPHENYL)5H6H(124)TRIAZOLO(32B)(13)THIAZOL6ONE
616210403
CCCCOC1=CC=CC=C1C=C2C(=O)N3C(=NC(=N3)C4=CC=C(C=C4)Cl)S2
CCCCOc1ccccc1C=c1sc2n(c1=O)nc(n2)c1ccc(cc1)Cl
InChI=1SC21H18ClN3O2Sc123122717754615(17)131820(26)2521(2818)2319(2425)1481016(22)11914h41113H2312H21H3b1813+
MFCD03665252
ZINC000002371410
ZINC02371410
ZINC2371410
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