Vitas-M small molecule compound
ethyl (2E)-2-(5-chloro-2-{[(4-methylphenyl)sulfonyl]oxy}benzylidene)-5-(4-chlorophenyl)-7-methyl-3-oxo-2,3-dihydro-5H-[1,3]thiazolo[3,2-a]pyrimidine-6-carboxylate
Catalog ID
STK094478
SMILES CCOC(=O)C1=C(C)N=c2n(C1c1ccc(cc1)Cl)c(=O)/c(=C\c1cc(Cl)ccc1OS(=O)(=O)c1ccc(cc1)C)/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 C30H24Cl2N2O6S2 MW 643.57 g/mol Purity >90% as per NMR
InChI
InChI=1S/C30H24Cl2N2O6S2/c1-4-39-29(36)26-18(3)33-30-34(27(26)19-7-9-21(31)10-8-19)28(35)25(41-30)16-20-15-22(32)11-14-24(20)40-42(37,38)23-12-5-17(2)6-13-23/h5-16,27H,4H2,1-3H3/b25-16+InChIKey
RANKLQCDUIIMQJ-PCLIKHOPSA-NSynonyms
CCOC(=O)C1=C(C)N=c2n(C1c1ccc(cc1)Cl)c(=O)c(=Cc1cc(Cl)ccc1OS(=O)(=O)c1ccc(cc1)C)s2
CCOC(=O)C1=C(N=C2N(C1C3=CC=C(C=C3)Cl)C(=O)C(=CC4=C(C=CC(=C4)Cl)OS(=O)(=O)C5=CC=C(C=C5)C)S2)C
ethyl(2E)2((5chloro2(4methylphenyl)sulfonyloxyphenyl)methylidene)5(4chlorophenyl)7methyl3oxo5H(13)thiazolo(32a)pyrimidine6carboxylate
ETHYL(2E)2(5CHLORO2(((4METHYLPHENYL)SULFONYL)OXY)BENZYLIDENE)5(4CHLOROPHENYL)7METHYL3OXO23DIHYDRO5H(13)THIAZOLO(32A)PYRIMIDINE6CARBOXYLATE
InChI=1SC30H24Cl2N2O6S2c143929(36)2618(3)333034(27(26)197921(31)10819)28(35)25(4130)16201522(32)111424(20)4042(3738)2312517(2)61323h51627H4H213H3b2516+
MFCD08672810
STK094478
ZINC000097959252
ZINC000097959253
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