Vitas-M small molecule compound
ethyl (2E)-2-{[1-(2,4-dichlorobenzyl)-1H-indol-3-yl]methylidene}-5-(2-methoxyphenyl)-7-methyl-3-oxo-2,3-dihydro-5H-[1,3]thiazolo[3,2-a]pyrimidine-6-carboxylate
Catalog ID
STL477124
SMILES CCOC(=O)C1=C(C)N=c2n(C1c1ccccc1OC)c(=O)/c(=C\c1cn(c3c1cccc3)Cc1ccc(cc1Cl)Cl)/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 C33H27Cl2N3O4S MW 632.57 g/mol Purity >90% as per NMR
InChI
InChI=1S/C33H27Cl2N3O4S/c1-4-42-32(40)29-19(2)36-33-38(30(29)24-10-6-8-12-27(24)41-3)31(39)28(43-33)15-21-18-37(26-11-7-5-9-23(21)26)17-20-13-14-22(34)16-25(20)35/h5-16,18,30H,4,17H2,1-3H3/b28-15+InChIKey
HATBKHBTIQLESI-RWPZCVJISA-NSynonyms
CCOC(=O)C1=C(C)N=c2n(C1c1ccccc1OC)c(=O)c(=Cc1cn(c3c1cccc3)Cc1ccc(cc1Cl)Cl)s2
CCOC(=O)C1=C(N=C2N(C1C3=CC=CC=C3OC)C(=O)C(=CC4=CN(C5=CC=CC=C54)CC6=C(C=C(C=C6)Cl)Cl)S2)C
ethyl(2E)2((1((24dichlorophenyl)methyl)indol3yl)methylidene)5(2methoxyphenyl)7methyl3oxo5H(13)thiazolo(32a)pyrimidine6carboxylate
ethyl(2E)2((1(24dichlorobenzyl)1Hindol3yl)methylidene)5(2methoxyphenyl)7methyl3oxo23dihydro5H(13)thiazolo(32a)pyrimidine6carboxylate
InChI=1SC33H27Cl2N3O4Sc144232(40)2919(2)363338(30(29)2410681227(24)413)31(39)28(4333)15211837(261175923(21)26)1720131422(34)1625(20)35h5161830H417H213H3b2815+
MFCD04083245
ZINC000150389878
ZINC000150389882
Check stock
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Check stock on Vitas-MAvailable files
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