Vitas-M small molecule compound
(5Z)-2-(4-bromophenyl)-5-[3-methoxy-4-(3-methylbutoxy)benzylidene][1,3]thiazolo[3,2-b][1,2,4]triazol-6(5H)-one
Catalog ID
STK702537
SMILES COc1cc(ccc1OCCC(C)C)/C=c/1\sc2n(c1=O)nc(n2)c1ccc(cc1)Br
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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 C23H22BrN3O3S MW 500.42 g/mol Purity >90% as per NMR
InChI
InChI=1S/C23H22BrN3O3S/c1-14(2)10-11-30-18-9-4-15(12-19(18)29-3)13-20-22(28)27-23(31-20)25-21(26-27)16-5-7-17(24)8-6-16/h4-9,12-14H,10-11H2,1-3H3/b20-13-InChIKey
XMTCCRMBUQOZBX-MOSHPQCFSA-NSynonyms
(5Z)2(4BROMOPHENYL)5((3METHOXY4(3METHYLBUTOXY)PHENYL)METHYLIDENE)(13)THIAZOLO(32B)(124)TRIAZOL6ONE
(5Z)2(4bromophenyl)5(3methoxy4(3methylbutoxy)benzylidene)(13)thiazolo(32b)(124)triazol6(5H)one
(E)2(4bromophenyl)5(4(isopentyloxy)3methoxybenzylidene)thiazolo(32b)(124)triazol6(5H)one
CC(C)CCOC1=C(C=C(C=C1)C=C2C(=O)N3C(=NC(=N3)C4=CC=C(C=C4)Br)S2)OC
COc1cc(ccc1OCCC(C)C)C=c1sc2n(c1=O)nc(n2)c1ccc(cc1)Br
InChI=1SC23H22BrN3O3Sc114(2)101130189415(1219(18)293)132022(28)2723(3120)2521(2627)165717(24)8616h491214H1011H213H3b2013
MFCD03016858
ZINC000022258419
ZINC22258419
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