Vitas-M small molecule compound
ethyl (2E)-2-{4-[(2-chlorobenzyl)oxy]benzylidene}-5-[4-(dimethylamino)phenyl]-7-methyl-3-oxo-2,3-dihydro-5H-[1,3]thiazolo[3,2-a]pyrimidine-6-carboxylate
Catalog ID
STK674117
SMILES CCOC(=O)C1=C(C)N=c2n(C1c1ccc(cc1)N(C)C)c(=O)/c(=C\c1ccc(cc1)OCc1ccccc1Cl)/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 C32H30ClN3O4S MW 588.13 g/mol Purity >90% as per NMR
InChI
InChI=1S/C32H30ClN3O4S/c1-5-39-31(38)28-20(2)34-32-36(29(28)22-12-14-24(15-13-22)35(3)4)30(37)27(41-32)18-21-10-16-25(17-11-21)40-19-23-8-6-7-9-26(23)33/h6-18,29H,5,19H2,1-4H3/b27-18+InChIKey
VDRABTGOLVROLD-OVVQPSECSA-NSynonyms
CCOC(=O)C1=C(C)N=c2n(C1c1ccc(cc1)N(C)C)c(=O)c(=Cc1ccc(cc1)OCc1ccccc1Cl)s2
CCOC(=O)C1=C(N=C2N(C1C3=CC=C(C=C3)N(C)C)C(=O)C(=CC4=CC=C(C=C4)OCC5=CC=CC=C5Cl)S2)C
ethyl(2E)2((4((2chlorophenyl)methoxy)phenyl)methylidene)5(4(dimethylamino)phenyl)7methyl3oxo5H(13)thiazolo(32a)pyrimidine6carboxylate
ETHYL(2E)2((4((2CHLOROPHENYL)METHOXY)PHENYL)METHYLIDENE)5(4DIMETHYLAMINOPHENYL)7METHYL3OXO5H(13)THIAZOLO(32A)PYRIMIDINE6CARBOXYLATE
ethyl(2E)2(4((2chlorobenzyl)oxy)benzylidene)5(4(dimethylamino)phenyl)7methyl3oxo23dihydro5H(13)thiazolo(32a)pyrimidine6carboxylate
ETHYL2(4((2CHLOROBENZYL)OXY)BENZYLIDENE)5(4(DIMETHYLAMINO)PHENYL)7METHYL3OXO23DIHYDRO5H(13)THIAZOLO(32A)PYRIMIDINE6CARBOXYLATE
InChI=1SC32H30ClN3O4Sc153931(38)2820(2)343236(29(28)22121424(151322)35(3)4)30(37)27(4132)1821101625(171121)401923867926(23)33h61829H519H214H3b2718+
MFCD01306113
ZINC000006354126
ZINC000006354129
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