Vitas-M small molecule compound

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

Catalog ID
STK541267
SMILES CC1C/C(=C\c2ccc(cc2)F)/C2=C(C1)C(c1ccc(cc1)F)n1c(=N2)scc1c1ccc2c(c1)OCCO2

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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 C32H26F2N2O2S MW 540.63 g/mol Purity >90% as per NMR
InChI
InChI=1S/C32H26F2N2O2S/c1-19-14-23(16-20-2-7-24(33)8-3-20)30-26(15-19)31(21-4-9-25(34)10-5-21)36-27(18-39-32(36)35-30)22-6-11-28-29(17-22)38-13-12-37-28/h2-11,16-19,31H,12-15H2,1H3/b23-16+
InChIKey
XHEUSVKQRBRGPE-XQNSMLJCSA-N
Synonyms
371922-69-9
(9E)3(23dihydro14benzodioxin6yl)5(4fluorophenyl)9((4fluorophenyl)methylidene)7methyl5678tetrahydro(13)thiazolo(23b)quinazoline
(9E)3(23dihydro14benzodioxin6yl)9(4fluorobenzylidene)5(4fluorophenyl)7methyl6789tetrahydro5H(13)thiazolo(23b)quinazoline
(E)3(23dihydrobenzo(b)(14)dioxin6yl)9(4fluorobenzylidene)5(4fluorophenyl)7methyl6789tetrahydro5Hthiazolo(23b)quinazoline
371922699
CC1CC(=CC2=CC=C(C=C2)F)C3=C(C1)C(N4C(=CSC4=N3)C5=CC6=C(C=C5)OCCO6)C7=CC=C(C=C7)F
CC1CC(=Cc2ccc(cc2)F)C2=C(C1)C(c1ccc(cc1)F)n1c(=N2)scc1c1ccc2c(c1)OCCO2
InChI=1SC32H26F2N2O2Sc1191423(16202724(33)8320)3026(1519)31(214925(34)10521)3627(183932(36)3530)226112829(1722)3813123728h211161931H1215H21H3b2316+
MFCD03007125
ZINC000004480214
ZINC000100808933

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Available files

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