Vitas-M small molecule compound

(5E)-5-(2-bromobenzylidene)-2-(4-ethoxyphenyl)[1,3]thiazolo[3,2-b][1,2,4]triazol-6(5H)-one

Catalog ID
STK814158
SMILES CCOc1ccc(cc1)c1nn2c(n1)s/c(=C/c1ccccc1Br)/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 C19H14BrN3O2S MW 428.31 g/mol Purity >90% as per NMR
InChI
InChI=1S/C19H14BrN3O2S/c1-2-25-14-9-7-12(8-10-14)17-21-19-23(22-17)18(24)16(26-19)11-13-5-3-4-6-15(13)20/h3-11H,2H2,1H3/b16-11+
InChIKey
RCRBPRNWKYKVHB-LFIBNONCSA-N
Synonyms
606956-03-0
(5E)5((2BROMOPHENYL)METHYLIDENE)2(4ETHOXYPHENYL)(13)THIAZOLO(32B)(124)TRIAZOL6ONE
(5E)5(2bromobenzylidene)2(4ethoxyphenyl)(13)thiazolo(32b)(124)triazol6(5H)one
5(2BROMOBENZYLIDENE)2(4ETHOXYPHENYL)THIAZOLO(32B)(124)TRIAZOL6(5H)ONE
606956030
CCOC1=CC=C(C=C1)C2=NN3C(=O)C(=CC4=CC=CC=C4Br)SC3=N2
CCOc1ccc(cc1)c1nn2c(n1)sc(=Cc1ccccc1Br)c2=O
InChI=1SC19H14BrN3O2Sc1225149712(81014)17211923(2217)18(24)16(2619)1113534615(13)20h311H2H21H3b1611+
MFCD04442009
ZINC000016730801
ZINC16730801

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Available files

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