Vitas-M small molecule compound

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

Catalog ID
STK998214
SMILES Brc1ccc(cc1)c1csc2=NC3=C(C(n12)c1ccccc1F)CCC/C/3=C\c1ccccc1F

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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 C29H21BrF2N2S MW 547.47 g/mol Purity >90% as per NMR
InChI
InChI=1S/C29H21BrF2N2S/c30-21-14-12-18(13-15-21)26-17-35-29-33-27-20(16-19-6-1-3-10-24(19)31)7-5-9-23(27)28(34(26)29)22-8-2-4-11-25(22)32/h1-4,6,8,10-17,28H,5,7,9H2/b20-16+
InChIKey
SWKFQOQWUQEGEF-CAPFRKAQSA-N
Synonyms
846064-15-1
(9E)3(4bromophenyl)5(2fluorophenyl)9((2fluorophenyl)methylidene)5678tetrahydro(13)thiazolo(23b)quinazoline
(9E)3(4bromophenyl)9(2fluorobenzylidene)5(2fluorophenyl)6789tetrahydro5H(13)thiazolo(23b)quinazoline
(E)3(4bromophenyl)9(2fluorobenzylidene)5(2fluorophenyl)6789tetrahydro5Hthiazolo(23b)quinazoline
846064151
Brc1ccc(cc1)c1csc2=NC3=C(C(n12)c1ccccc1F)CCCC3=Cc1ccccc1F
C1CC(=CC2=CC=CC=C2F)C3=C(C1)C(N4C(=CSC4=N3)C5=CC=C(C=C5)Br)C6=CC=CC=C6F
InChI=1SC29H21BrF2N2Sc3021141218(131521)26173529332720(16196131024(19)31)75923(27)28(34(26)29)228241125(22)32h1468101728H579H2b2016+
MFCD04173848
ZINC000101125722
ZINC000101125725

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Available files

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