Vitas-M small molecule compound
ethyl (2Z)-2-{[1-(2-chlorobenzyl)-1H-indol-3-yl]methylidene}-5-(4-methoxyphenyl)-7-methyl-3-oxo-2,3-dihydro-5H-[1,3]thiazolo[3,2-a]pyrimidine-6-carboxylate
Catalog ID
STK522629
SMILES CCOC(=O)C1=C(C)N=c2n(C1c1ccc(cc1)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 C33H28ClN3O4S MW 598.12 g/mol Purity >90% as per NMR
InChI
InChI=1S/C33H28ClN3O4S/c1-4-41-32(39)29-20(2)35-33-37(30(29)21-13-15-24(40-3)16-14-21)31(38)28(42-33)17-23-19-36(27-12-8-6-10-25(23)27)18-22-9-5-7-11-26(22)34/h5-17,19,30H,4,18H2,1-3H3/b28-17-InChIKey
SEFIPOKBOUCBIE-QRQIAZFYSA-NSynonyms
CCOC(=O)C1=C(C)N=c2n(C1c1ccc(cc1)OC)c(=O)c(=Cc1cn(c3c1cccc3)Cc1ccccc1Cl)s2
CCOC(=O)C1=C(N=C2N(C1C3=CC=C(C=C3)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(4METHOXYPHENYL)7METHYL3OXO5H(13)THIAZOLO(32A)PYRIMIDINE6CARBOXYLATE
ethyl(2Z)2((1(2chlorobenzyl)1Hindol3yl)methylidene)5(4methoxyphenyl)7methyl3oxo23dihydro5H(13)thiazolo(32a)pyrimidine6carboxylate
InChI=1SC33H28ClN3O4Sc144132(39)2920(2)353337(30(29)21131524(403)161421)31(38)28(4233)17231936(2712861025(23)27)18229571126(22)34h5171930H418H213H3b2817
MFCD01592616
ZINC000100618627
ZINC000100618630
Check stock
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Check stock on Vitas-MAvailable files
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