Vitas-M small molecule compound
ethyl (2Z)-2-{[1-(2-chlorobenzyl)-1H-indol-3-yl]methylidene}-5-(2,4-dimethoxyphenyl)-7-methyl-3-oxo-2,3-dihydro-5H-[1,3]thiazolo[3,2-a]pyrimidine-6-carboxylate
Catalog ID
STL436521
SMILES CCOC(=O)C1=C(C)N=c2n(C1c1ccc(cc1OC)OC)c(=O)/c(=C/c1cn(c3c1cccc3)Cc1ccccc1Cl)/s2
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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 C34H30ClN3O5S MW 628.15 g/mol Purity >90% as per NMR
InChI
InChI=1S/C34H30ClN3O5S/c1-5-43-33(40)30-20(2)36-34-38(31(30)25-15-14-23(41-3)17-28(25)42-4)32(39)29(44-34)16-22-19-37(27-13-9-7-11-24(22)27)18-21-10-6-8-12-26(21)35/h6-17,19,31H,5,18H2,1-4H3/b29-16-InChIKey
HRACKHGSEUZWPP-MWLSYYOVSA-NSynonyms
CCOC(=O)C1=C(C)N=c2n(C1c1ccc(cc1OC)OC)c(=O)c(=Cc1cn(c3c1cccc3)Cc1ccccc1Cl)s2
CCOC(=O)C1=C(N=C2N(C1C3=C(C=C(C=C3)OC)OC)C(=O)C(=CC4=CN(C5=CC=CC=C54)CC6=CC=CC=C6Cl)S2)C
ETHYL(2Z)2((1((2CHLOROPHENYL)METHYL)INDOL3YL)METHYLIDENE)5(24DIMETHOXYPHENYL)7METHYL3OXO5H(13)THIAZOLO(32A)PYRIMIDINE6CARBOXYLATE
ethyl(2Z)2((1(2chlorobenzyl)1Hindol3yl)methylidene)5(24dimethoxyphenyl)7methyl3oxo23dihydro5H(13)thiazolo(32a)pyrimidine6carboxylate
InChI=1SC34H30ClN3O5Sc154333(40)3020(2)363438(31(30)25151423(413)1728(25)424)32(39)29(4434)16221937(2713971124(22)27)182110681226(21)35h6171931H518H214H3b2916
MFCD01591952
ZINC000008694841
ZINC000008695541
Check stock
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Check stock on Vitas-MAvailable files
Download the SDF, MOL, 3D structure and SDS documents from Vitas-M.