Vitas-M small molecule compound
ethyl (2Z)-2-[(5-iodofuran-2-yl)methylidene]-5-(3-methoxyphenyl)-3-oxo-7-phenyl-2,3-dihydro-5H-[1,3]thiazolo[3,2-a]pyrimidine-6-carboxylate
Catalog ID
STL164251
SMILES CCOC(=O)C1=C(N=c2n(C1c1cccc(c1)OC)c(=O)/c(=C/c1ccc(o1)I)/s2)c1ccccc1
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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 C27H21IN2O5S MW 612.44 g/mol Purity >90% as per NMR
InChI
InChI=1S/C27H21IN2O5S/c1-3-34-26(32)22-23(16-8-5-4-6-9-16)29-27-30(24(22)17-10-7-11-18(14-17)33-2)25(31)20(36-27)15-19-12-13-21(28)35-19/h4-15,24H,3H2,1-2H3/b20-15-InChIKey
FDUKVNVFOJSLGN-HKWRFOASSA-NSynonyms
CCOC(=O)C1=C(N=c2n(C1c1cccc(c1)OC)c(=O)c(=Cc1ccc(o1)I)s2)c1ccccc1
CCOC(=O)C1=C(N=C2N(C1C3=CC(=CC=C3)OC)C(=O)C(=CC4=CC=C(O4)I)S2)C5=CC=CC=C5
ethyl(2Z)2((5iodofuran2yl)methylidene)5(3methoxyphenyl)3oxo7phenyl23dihydro5H(13)thiazolo(32a)pyrimidine6carboxylate
ETHYL(2Z)2((5IODOFURAN2YL)METHYLIDENE)5(3METHOXYPHENYL)3OXO7PHENYL5H(13)THIAZOLO(32A)PYRIMIDINE6CARBOXYLATE
ETHYL2((5IODO2FURYL)METHYLENE)5(3METHOXYPHENYL)3OXO7PHENYL23DIHYDRO5H(13)THIAZOLO(32A)PYRIMIDINE6CARBOXYLATE
InChI=1SC27H21IN2O5Sc133426(32)2223(168546916)292730(24(22)171071118(1417)332)25(31)20(3627)1519121321(28)3519h41524H3H212H3b2015
MFCD02951670
ZINC000008451545
ZINC000008451547
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