Vitas-M small molecule compound

ethyl (2E)-2-{[1-(4-bromobenzyl)-1H-indol-3-yl]methylidene}-5-(2,5-dimethoxyphenyl)-3-oxo-7-phenyl-2,3-dihydro-5H-[1,3]thiazolo[3,2-a]pyrimidine-6-carboxylate

Catalog ID
STL440429
SMILES CCOC(=O)C1=C(N=c2n(C1c1cc(OC)ccc1OC)c(=O)/c(=C\c1cn(c3c1cccc3)Cc1ccc(cc1)Br)/s2)c1ccccc1

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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 C39H32BrN3O5S MW 734.67 g/mol Purity >90% as per NMR
InChI
InChI=1S/C39H32BrN3O5S/c1-4-48-38(45)34-35(25-10-6-5-7-11-25)41-39-43(36(34)30-21-28(46-2)18-19-32(30)47-3)37(44)33(49-39)20-26-23-42(31-13-9-8-12-29(26)31)22-24-14-16-27(40)17-15-24/h5-21,23,36H,4,22H2,1-3H3/b33-20+
InChIKey
GLLLBZIBICMEAA-FMFFXOCNSA-N
Synonyms

CCOC(=O)C1=C(N=c2n(C1c1cc(OC)ccc1OC)c(=O)c(=Cc1cn(c3c1cccc3)Cc1ccc(cc1)Br)s2)c1ccccc1
ethyl(2E)2((1(4bromobenzyl)1Hindol3yl)methylidene)5(25dimethoxyphenyl)3oxo7phenyl23dihydro5H(13)thiazolo(32a)pyrimidine6carboxylate
MFCD30712092
ZINC000150608255
ZINC000150608258

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Available files

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