Vitas-M small molecule compound
ethyl (2Z)-5-(4-chlorophenyl)-2-(3-iodo-4,5-dimethoxybenzylidene)-7-methyl-3-oxo-2,3-dihydro-5H-[1,3]thiazolo[3,2-a]pyrimidine-6-carboxylate
Catalog ID
STK522590
SMILES CCOC(=O)C1=C(C)N=c2n(C1c1ccc(cc1)Cl)c(=O)/c(=C/c1cc(I)c(c(c1)OC)OC)/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 C25H22ClIN2O5S MW 624.88 g/mol Purity >90% as per NMR
InChI
InChI=1S/C25H22ClIN2O5S/c1-5-34-24(31)20-13(2)28-25-29(21(20)15-6-8-16(26)9-7-15)23(30)19(35-25)12-14-10-17(27)22(33-4)18(11-14)32-3/h6-12,21H,5H2,1-4H3/b19-12-InChIKey
PZLMETVSQVFVKY-UNOMPAQXSA-NSynonyms
CCOC(=O)C1=C(C)N=c2n(C1c1ccc(cc1)Cl)c(=O)c(=Cc1cc(I)c(c(c1)OC)OC)s2
CCOC(=O)C1=C(N=C2N(C1C3=CC=C(C=C3)Cl)C(=O)C(=CC4=CC(=C(C(=C4)I)OC)OC)S2)C
ETHYL(2Z)5(4CHLOROPHENYL)2((3IODO45DIMETHOXYPHENYL)METHYLIDENE)7METHYL3OXO5H(13)THIAZOLO(32A)PYRIMIDINE6CARBOXYLATE
ethyl(2Z)5(4chlorophenyl)2(3iodo45dimethoxybenzylidene)7methyl3oxo23dihydro5H(13)thiazolo(32a)pyrimidine6carboxylate
InChI=1SC25H22ClIN2O5Sc153424(31)2013(2)282529(21(20)156816(26)9715)23(30)19(3525)12141017(27)22(334)18(1114)323h61221H5H214H3b1912
MFCD02378691
ZINC000096022233
ZINC000096022234
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