Vitas-M small molecule compound
ethyl (2Z)-2-{3-[(4-iodophenoxy)methyl]-4-methoxybenzylidene}-5-(4-methoxyphenyl)-7-methyl-3-oxo-2,3-dihydro-5H-[1,3]thiazolo[3,2-a]pyrimidine-6-carboxylate
Catalog ID
STL173666
SMILES CCOC(=O)C1=C(C)N=c2n(C1c1ccc(cc1)OC)c(=O)/c(=C/c1ccc(c(c1)COc1ccc(cc1)I)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 C32H29IN2O6S MW 696.56 g/mol Purity >90% as per NMR
InChI
InChI=1S/C32H29IN2O6S/c1-5-40-31(37)28-19(2)34-32-35(29(28)21-7-11-24(38-3)12-8-21)30(36)27(42-32)17-20-6-15-26(39-4)22(16-20)18-41-25-13-9-23(33)10-14-25/h6-17,29H,5,18H2,1-4H3/b27-17-InChIKey
YSUPUVZADHFSLG-PKAZHMFMSA-NSynonyms
445245-97-6445245976
CCOC(=O)C1=C(C)N=c2n(C1c1ccc(cc1)OC)c(=O)c(=Cc1ccc(c(c1)COc1ccc(cc1)I)OC)s2
CCOC(=O)C1=C(N=C2N(C1C3=CC=C(C=C3)OC)C(=O)C(=CC4=CC(=C(C=C4)OC)COC5=CC=C(C=C5)I)S2)C
ETHYL(2Z)2((3((4IODOPHENOXY)METHYL)4METHOXYPHENYL)METHYLIDENE)5(4METHOXYPHENYL)7METHYL3OXO5H(13)THIAZOLO(32A)PYRIMIDINE6CARBOXYLATE
ethyl(2Z)2(3((4iodophenoxy)methyl)4methoxybenzylidene)5(4methoxyphenyl)7methyl3oxo23dihydro5H(13)thiazolo(32a)pyrimidine6carboxylate
ETHYL2(3((4IODOPHENOXY)METHYL)4METHOXYBENZYLIDENE)5(4METHOXYPHENYL)7METHYL3OXO23DIHYDRO5H(13)THIAZOLO(32A)PYRIMIDINE6CARBOXYLATE
InChI=1SC32H29IN2O6Sc154031(37)2819(2)343235(29(28)2171124(383)12821)30(36)27(4232)172061526(394)22(1620)18412513923(33)101425h61729H518H214H3b2717
MFCD02243302
ZINC000008454756
ZINC000008454757
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