Vitas-M small molecule compound
propan-2-yl (2E)-2-(2,4-dichlorobenzylidene)-5-(4-methoxyphenyl)-7-methyl-3-oxo-2,3-dihydro-5H-[1,3]thiazolo[3,2-a]pyrimidine-6-carboxylate
Catalog ID
STK793885
SMILES COc1ccc(cc1)C1C(=C(C)N=c2n1c(=O)/c(=C\c1ccc(cc1Cl)Cl)/s2)C(=O)OC(C)C
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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 C25H22Cl2N2O4S MW 517.43 g/mol Purity >90% as per NMR
InChI
InChI=1S/C25H22Cl2N2O4S/c1-13(2)33-24(31)21-14(3)28-25-29(22(21)15-6-9-18(32-4)10-7-15)23(30)20(34-25)11-16-5-8-17(26)12-19(16)27/h5-13,22H,1-4H3/b20-11+InChIKey
MZNHZBHJJBVSAR-RGVLZGJSSA-NSynonyms
(Z)isopropyl2(24dichlorobenzylidene)5(4methoxyphenyl)7methyl3oxo35dihydro2Hthiazolo(32a)pyrimidine6carboxylate
CC1=C(C(N2C(=O)C(=CC3=C(C=C(C=C3)Cl)Cl)SC2=N1)C4=CC=C(C=C4)OC)C(=O)OC(C)C
COc1ccc(cc1)C1C(=C(C)N=c2n1c(=O)c(=Cc1ccc(cc1Cl)Cl)s2)C(=O)OC(C)C
InChI=1SC25H22Cl2N2O4Sc113(2)3324(31)2114(3)282529(22(21)156918(324)10715)23(30)20(3425)11165817(26)1219(16)27h51322H14H3b2011+
MFCD03417139
propan2yl(2E)2((24dichlorophenyl)methylidene)5(4methoxyphenyl)7methyl3oxo5H(13)thiazolo(32a)pyrimidine6carboxylate
propan2yl(2E)2(24dichlorobenzylidene)5(4methoxyphenyl)7methyl3oxo23dihydro5H(13)thiazolo(32a)pyrimidine6carboxylate
ZINC000012294041
ZINC000012294043
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