Vitas-M small molecule compound

(9E)-3-(4-bromophenyl)-9-[4-(difluoromethoxy)-3-methoxybenzylidene]-5-[4-(difluoromethoxy)-3-methoxyphenyl]-6,7,8,9-tetrahydro-5H-[1,3]thiazolo[2,3-b]quinazoline

Catalog ID
STK543413
SMILES COc1cc(ccc1OC(F)F)/C=C/1\CCCC2=C1N=c1scc(n1C2c1ccc(c(c1)OC)OC(F)F)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 C33H27BrF4N2O4S MW 703.55 g/mol Purity >90% as per NMR
InChI
InChI=1S/C33H27BrF4N2O4S/c1-41-27-15-18(6-12-25(27)43-31(35)36)14-20-4-3-5-23-29(20)39-33-40(24(17-45-33)19-7-10-22(34)11-8-19)30(23)21-9-13-26(44-32(37)38)28(16-21)42-2/h6-17,30-32H,3-5H2,1-2H3/b20-14+
InChIKey
HMVUSDXWMFVQRH-XSFVSMFZSA-N
Synonyms

(9E)3(4bromophenyl)5(4(difluoromethoxy)3methoxyphenyl)9((4(difluoromethoxy)3methoxyphenyl)methylidene)5678tetrahydro(13)thiazolo(23b)quinazoline
(9E)3(4bromophenyl)9(4(difluoromethoxy)3methoxybenzylidene)5(4(difluoromethoxy)3methoxyphenyl)6789tetrahydro5H(13)thiazolo(23b)quinazoline
(E)3(4bromophenyl)9(4(difluoromethoxy)3methoxybenzylidene)5(4(difluoromethoxy)3methoxyphenyl)6789tetrahydro5Hthiazolo(23b)quinazoline
COC1=C(C=CC(=C1)C=C2CCCC3=C2N=C4N(C3C5=CC(=C(C=C5)OC(F)F)OC)C(=CS4)C6=CC=C(C=C6)Br)OC(F)F
COc1cc(ccc1OC(F)F)C=C1CCCC2=C1N=c1scc(n1C2c1ccc(c(c1)OC)OC(F)F)c1ccc(cc1)Br
InChI=1SC33H27BrF4N2O4Sc141271518(61225(27)4331(35)36)14204352329(20)393340(24(174533)1971022(34)11819)30(23)2191326(4432(37)38)28(1621)422h6173032H35H212H3b2014+
MFCD03289907
ZINC000150425333
ZINC000150425337

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Available files

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