Vitas-M small molecule compound
(2Z)-2-(3-bromo-5-methoxy-4-{2-[2-(prop-2-en-1-yl)phenoxy]ethoxy}benzylidene)[1,3]thiazolo[3,2-a]benzimidazol-3(2H)-one
Catalog ID
STK075199
SMILES C=CCc1ccccc1OCCOc1c(Br)cc(cc1OC)/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 C28H23BrN2O4S MW 563.47 g/mol Purity >90% as per NMR
InChI
InChI=1S/C28H23BrN2O4S/c1-3-8-19-9-4-7-12-23(19)34-13-14-35-26-20(29)15-18(16-24(26)33-2)17-25-27(32)31-22-11-6-5-10-21(22)30-28(31)36-25/h3-7,9-12,15-17H,1,8,13-14H2,2H3/b25-17-InChIKey
RUXSKNNRLFVBIS-UQQQWYQISA-NSynonyms
(2Z)2((3BROMO5METHOXY4(2(2PROP2ENYLPHENOXY)ETHOXY)PHENYL)METHYLIDENE)(13)THIAZOLO(32A)BENZIMIDAZOL1ONE
(2Z)2(3BROMO5METHOXY4(2(2(PROP2EN1YL)PHENOXY)ETHOXY)BENZYLIDENE)(13)THIAZOLO(32A)BENZIMIDAZOL3(2H)ONE
C=CCc1ccccc1OCCOc1c(Br)cc(cc1OC)C=c1sc2n(c1=O)c1c(n2)cccc1
COC1=C(C(=CC(=C1)C=C2C(=O)N3C4=CC=CC=C4N=C3S2)Br)OCCOC5=CC=CC=C5CC=C
InChI=1SC28H23BrN2O4Sc138199471223(19)341314352620(29)1518(1624(26)332)172527(32)312211651021(22)3028(31)3625h379121517H181314H22H3b2517
MFCD02122637
STK075199
ZINC000059821621
ZINC59821621
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