Vitas-M small molecule compound

(2Z)-2-{2-[2-(4-chloro-3-methylphenoxy)ethoxy]-5-methoxybenzylidene}[1,3]thiazolo[3,2-a]benzimidazol-3(2H)-one

Catalog ID
STK070353
SMILES COc1ccc(c(c1)/C=c/1\sc2n(c1=O)c1c(n2)cccc1)OCCOc1ccc(c(c1)C)Cl

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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 C26H21ClN2O4S MW 492.98 g/mol Purity >90% as per NMR
InChI
InChI=1S/C26H21ClN2O4S/c1-16-13-19(7-9-20(16)27)32-11-12-33-23-10-8-18(31-2)14-17(23)15-24-25(30)29-22-6-4-3-5-21(22)28-26(29)34-24/h3-10,13-15H,11-12H2,1-2H3/b24-15-
InChIKey
WEFRHGITHVAQAO-IWIPYMOSSA-N
Synonyms

(2Z)2((2(2(4CHLORO3METHYLPHENOXY)ETHOXY)5METHOXYPHENYL)METHYLIDENE)(13)THIAZOLO(32A)BENZIMIDAZOL1ONE
(2Z)2(2(2(4CHLORO3METHYLPHENOXY)ETHOXY)5METHOXYBENZYLIDENE)(13)THIAZOLO(32A)BENZIMIDAZOL3(2H)ONE
CC1=C(C=CC(=C1)OCCOC2=C(C=C(C=C2)OC)C=C3C(=O)N4C5=CC=CC=C5N=C4S3)Cl
COc1ccc(c(c1)C=c1sc2n(c1=O)c1c(n2)cccc1)OCCOc1ccc(c(c1)C)Cl
InChI=1SC26H21ClN2O4Sc1161319(7920(16)27)321112332310818(312)1417(23)152425(30)2922643521(22)2826(29)3424h3101315H1112H212H3b2415
MFCD05975748
STK070353
ZINC000009635710
ZINC09635710
ZINC9635710

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Available files

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