Vitas-M small molecule compound
(2Z)-2-{3-bromo-5-methoxy-4-[(2-methylbenzyl)oxy]benzylidene}[1,3]thiazolo[3,2-a]benzimidazol-3(2H)-one
Catalog ID
STK712243
SMILES COc1cc(cc(c1OCc1ccccc1C)Br)/C=c/1\sc2n(c1=O)c1c(n2)cccc1
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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 C25H19BrN2O3S MW 507.41 g/mol Purity >90% as per NMR
InChI
InChI=1S/C25H19BrN2O3S/c1-15-7-3-4-8-17(15)14-31-23-18(26)11-16(12-21(23)30-2)13-22-24(29)28-20-10-6-5-9-19(20)27-25(28)32-22/h3-13H,14H2,1-2H3/b22-13-InChIKey
PTOBVYLERDTFQC-XKZIYDEJSA-NSynonyms
(2Z)2((3BROMO5METHOXY4((2METHYLPHENYL)METHOXY)PHENYL)METHYLIDENE)(13)THIAZOLO(32A)BENZIMIDAZOL1ONE
(2Z)2(3bromo5methoxy4((2methylbenzyl)oxy)benzylidene)(13)thiazolo(32a)benzimidazol3(2H)one
(E)2(3bromo5methoxy4((2methylbenzyl)oxy)benzylidene)benzo(45)imidazo(21b)thiazol3(2H)one
CC1=CC=CC=C1COC2=C(C=C(C=C2Br)C=C3C(=O)N4C5=CC=CC=C5N=C4S3)OC
COc1cc(cc(c1OCc1ccccc1C)Br)C=c1sc2n(c1=O)c1c(n2)cccc1
InChI=1SC25H19BrN2O3Sc115734817(15)14312318(26)1116(1221(23)302)132224(29)28201065919(20)2725(28)3222h313H14H212H3b2213
MFCD05975755
ZINC000033890243
ZINC33890243
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