Vitas-M small molecule compound

(2Z)-2-{3-chloro-4-[3-(2,6-dimethylphenoxy)propoxy]-5-methoxybenzylidene}[1,3]thiazolo[3,2-a]benzimidazol-3(2H)-one

Catalog ID
STK554243
SMILES COc1cc(cc(c1OCCCOc1c(C)cccc1C)Cl)/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 C28H25ClN2O4S MW 521.04 g/mol Purity >90% as per NMR
InChI
InChI=1S/C28H25ClN2O4S/c1-17-8-6-9-18(2)25(17)34-12-7-13-35-26-20(29)14-19(15-23(26)33-3)16-24-27(32)31-22-11-5-4-10-21(22)30-28(31)36-24/h4-6,8-11,14-16H,7,12-13H2,1-3H3/b24-16-
InChIKey
FIAUYKWVVDPRRK-JLPGSUDCSA-N
Synonyms
840472-39-1
(2Z)2((3CHLORO4(3(26DIMETHYLPHENOXY)PROPOXY)5METHOXYPHENYL)METHYLIDENE)(13)THIAZOLO(32A)BENZIMIDAZOL1ONE
(2Z)2(3chloro4(3(26dimethylphenoxy)propoxy)5methoxybenzylidene)(13)thiazolo(32a)benzimidazol3(2H)one
(Z)2(3chloro4(3(26dimethylphenoxy)propoxy)5methoxybenzylidene)benzo(45)imidazo(21b)thiazol3(2H)one
840472391
CC1=C(C(=CC=C1)C)OCCCOC2=C(C=C(C=C2Cl)C=C3C(=O)N4C5=CC=CC=C5N=C4S3)OC
COc1cc(cc(c1OCCCOc1c(C)cccc1C)Cl)C=c1sc2n(c1=O)c1c(n2)cccc1
InChI=1SC28H25ClN2O4Sc11786918(2)25(17)3412713352620(29)1419(1523(26)333)162427(32)312211541021(22)3028(31)3624h468111416H71213H213H3b2416
MFCD04005443
ZINC000009462344
ZINC09462344
ZINC9462344

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Available files

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