Vitas-M small molecule compound

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

Catalog ID
STK538898
SMILES CC1C/C(=C\c2ccc(cc2)F)/C2=C(C1)C(c1ccc(cc1)F)n1c(=N2)scc1c1cccc(c1)[N+](=O)[O-]

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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 C30H23F2N3O2S MW 527.59 g/mol Purity >90% as per NMR
InChI
InChI=1S/C30H23F2N3O2S/c1-18-13-22(15-19-5-9-23(31)10-6-19)28-26(14-18)29(20-7-11-24(32)12-8-20)34-27(17-38-30(34)33-28)21-3-2-4-25(16-21)35(36)37/h2-12,15-18,29H,13-14H2,1H3/b22-15+
InChIKey
GWLCTGUEUKEYNQ-PXLXIMEGSA-N
Synonyms
369401-12-7
(9E)5(4fluorophenyl)9((4fluorophenyl)methylidene)7methyl3(3nitrophenyl)5678tetrahydro(13)thiazolo(23b)quinazoline
(9E)9(4fluorobenzylidene)5(4fluorophenyl)7methyl3(3nitrophenyl)6789tetrahydro5H(13)thiazolo(23b)quinazoline
(E)9(4fluorobenzylidene)5(4fluorophenyl)7methyl3(3nitrophenyl)6789tetrahydro5Hthiazolo(23b)quinazoline
369401127
CC1CC(=CC2=CC=C(C=C2)F)C3=C(C1)C(N4C(=CSC4=N3)C5=CC(=CC=C5)(N+)(=O)(O))C6=CC=C(C=C6)F
CC1CC(=Cc2ccc(cc2)F)C2=C(C1)C(c1ccc(cc1)F)n1c(=N2)scc1c1cccc(c1)(N+)(=O)(O)
InChI=1SC30H23F2N3O2Sc1181322(15195923(31)10619)2826(1418)29(2071124(32)12820)3427(173830(34)3328)2132425(1621)35(36)37h212151829H1314H21H3b2215+
MFCD03010760
ZINC000100817569
ZINC000100817575

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Available files

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