Vitas-M small molecule compound
ethyl (2Z)-5-[4-(dimethylamino)phenyl]-2-[3-iodo-5-methoxy-4-(naphthalen-1-ylmethoxy)benzylidene]-7-methyl-3-oxo-2,3-dihydro-5H-[1,3]thiazolo[3,2-a]pyrimidine-6-carboxylate
Catalog ID
STK522610
SMILES CCOC(=O)C1=C(C)N=c2n(C1c1ccc(cc1)N(C)C)c(=O)/c(=C/c1cc(I)c(c(c1)OC)OCc1cccc3c1cccc3)/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 C37H34IN3O5S MW 759.66 g/mol Purity >90% as per NMR
InChI
InChI=1S/C37H34IN3O5S/c1-6-45-36(43)32-22(2)39-37-41(33(32)25-14-16-27(17-15-25)40(3)4)35(42)31(47-37)20-23-18-29(38)34(30(19-23)44-5)46-21-26-12-9-11-24-10-7-8-13-28(24)26/h7-20,33H,6,21H2,1-5H3/b31-20-InChIKey
KJSDNOSFKLZQOJ-GTWSWNCMSA-NSynonyms
CCOC(=O)C1=C(C)N=c2n(C1c1ccc(cc1)N(C)C)c(=O)c(=Cc1cc(I)c(c(c1)OC)OCc1cccc3c1cccc3)s2
CCOC(=O)C1=C(N=C2N(C1C3=CC=C(C=C3)N(C)C)C(=O)C(=CC4=CC(=C(C(=C4)I)OCC5=CC=CC6=CC=CC=C65)OC)S2)C
ethyl(2Z)5(4(dimethylamino)phenyl)2((3iodo5methoxy4(naphthalen1ylmethoxy)phenyl)methylidene)7methyl3oxo5H(13)thiazolo(32a)pyrimidine6carboxylate
ethyl(2Z)5(4(dimethylamino)phenyl)2(3iodo5methoxy4(naphthalen1ylmethoxy)benzylidene)7methyl3oxo23dihydro5H(13)thiazolo(32a)pyrimidine6carboxylate
ETHYL(2Z)5(4DIMETHYLAMINOPHENYL)2((3IODO5METHOXY4(NAPHTHALEN1YLMETHOXY)PHENYL)METHYLIDENE)7METHYL3OXO5H(13)THIAZOLO(32A)PYRIMIDINE6CARBOXYLATE
InChI=1SC37H34IN3O5Sc164536(43)3222(2)393741(33(32)25141627(171525)40(3)4)35(42)31(4737)20231829(38)34(30(1923)445)462126129112410781328(24)26h72033H621H215H3b3120
MFCD02378704
ZINC000097966288
ZINC000097966289
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