Vitas-M small molecule compound
(5Z)-5-(5-bromo-2-methoxybenzylidene)-2-(4-butoxyphenyl)[1,3]thiazolo[3,2-b][1,2,4]triazol-6(5H)-one
Catalog ID
STK815532
SMILES CCCCOc1ccc(cc1)c1nn2c(n1)s/c(=C\c1cc(Br)ccc1OC)/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 C22H20BrN3O3S MW 486.39 g/mol Purity >90% as per NMR
InChI
InChI=1S/C22H20BrN3O3S/c1-3-4-11-29-17-8-5-14(6-9-17)20-24-22-26(25-20)21(27)19(30-22)13-15-12-16(23)7-10-18(15)28-2/h5-10,12-13H,3-4,11H2,1-2H3/b19-13-InChIKey
CAPDUOIELXBEAX-UYRXBGFRSA-NSynonyms
(5Z)5((5BROMO2METHOXYPHENYL)METHYLIDENE)2(4BUTOXYPHENYL)(13)THIAZOLO(32B)(124)TRIAZOL6ONE
(5Z)5(5bromo2methoxybenzylidene)2(4butoxyphenyl)(13)thiazolo(32b)(124)triazol6(5H)one
5((5BROMO2METHOXYPHENYL)METHYLENE)2(4BUTOXYPHENYL)13THIAZOLIDINO(32D)124TRIAZOL6ONE
CCCCOC1=CC=C(C=C1)C2=NN3C(=O)C(=CC4=C(C=CC(=C4)Br)OC)SC3=N2
CCCCOc1ccc(cc1)c1nn2c(n1)sc(=Cc1cc(Br)ccc1OC)c2=O
InChI=1SC22H20BrN3O3Sc1341129178514(6917)20242226(2520)21(27)19(3022)13151216(23)71018(15)282h5101213H3411H212H3b1913
MFCD03533220
ZINC000003636988
ZINC03636988
ZINC3636988
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