Vitas-M small molecule compound
(5Z)-2-(2-bromophenyl)-5-(3,4-diethoxybenzylidene)[1,3]thiazolo[3,2-b][1,2,4]triazol-6(5H)-one
Catalog ID
STK800398
SMILES CCOc1cc(ccc1OCC)/C=c/1\sc2n(c1=O)nc(n2)c1ccccc1Br
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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 C21H18BrN3O3S MW 472.36 g/mol Purity >90% as per NMR
InChI
InChI=1S/C21H18BrN3O3S/c1-3-27-16-10-9-13(11-17(16)28-4-2)12-18-20(26)25-21(29-18)23-19(24-25)14-7-5-6-8-15(14)22/h5-12H,3-4H2,1-2H3/b18-12-InChIKey
CXXJDRKGHHIWAT-PDGQHHTCSA-NSynonyms
573931-10-9(5Z)2(2BROMOPHENYL)5((34DIETHOXYPHENYL)METHYLIDENE)(13)THIAZOLO(32B)(124)TRIAZOL6ONE
(5Z)2(2bromophenyl)5(34diethoxybenzylidene)(13)thiazolo(32b)(124)triazol6(5H)one
(Z)2(2bromophenyl)5(34diethoxybenzylidene)thiazolo(32b)(124)triazol6(5H)one
573931109
CCOC1=C(C=C(C=C1)C=C2C(=O)N3C(=NC(=N3)C4=CC=CC=C4Br)S2)OCC
CCOc1cc(ccc1OCC)C=c1sc2n(c1=O)nc(n2)c1ccccc1Br
InChI=1SC21H18BrN3O3Sc13271610913(1117(16)2842)121820(26)2521(2918)2319(2425)14756815(14)22h512H34H212H3b1812
MFCD04019592
ZINC000013514443
ZINC13514443
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