Vitas-M small molecule compound
ethyl (2Z)-2-({5-[(2,4-difluorophenoxy)methyl]furan-2-yl}methylidene)-7-methyl-3-oxo-5-phenyl-2,3-dihydro-5H-[1,3]thiazolo[3,2-a]pyrimidine-6-carboxylate
Catalog ID
STL174228
SMILES CCOC(=O)C1=C(C)N=c2n(C1c1ccccc1)c(=O)/c(=C/c1ccc(o1)COc1ccc(cc1F)F)/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 C28H22F2N2O5S MW 536.56 g/mol Purity >90% as per NMR
InChI
InChI=1S/C28H22F2N2O5S/c1-3-35-27(34)24-16(2)31-28-32(25(24)17-7-5-4-6-8-17)26(33)23(38-28)14-19-10-11-20(37-19)15-36-22-12-9-18(29)13-21(22)30/h4-14,25H,3,15H2,1-2H3/b23-14-InChIKey
JEBVSVFHYOOIQO-UCQKPKSFSA-NSynonyms
445239-55-4445239554
CCOC(=O)C1=C(C)N=c2n(C1c1ccccc1)c(=O)c(=Cc1ccc(o1)COc1ccc(cc1F)F)s2
CCOC(=O)C1=C(N=C2N(C1C3=CC=CC=C3)C(=O)C(=CC4=CC=C(O4)COC5=C(C=C(C=C5)F)F)S2)C
ethyl(2Z)2((5((24difluorophenoxy)methyl)furan2yl)methylidene)7methyl3oxo5phenyl23dihydro5H(13)thiazolo(32a)pyrimidine6carboxylate
ETHYL(2Z)2((5((24DIFLUOROPHENOXY)METHYL)FURAN2YL)METHYLIDENE)7METHYL3OXO5PHENYL5H(13)THIAZOLO(32A)PYRIMIDINE6CARBOXYLATE
ETHYL2((5((24DIFLUOROPHENOXY)METHYL)2FURYL)METHYLENE)7METHYL3OXO5PHENYL23DIHYDRO5H(13)THIAZOLO(32A)PYRIMIDINE6CARBOXYLATE
InChI=1SC28H22F2N2O5Sc133527(34)2416(2)312832(25(24)177546817)26(33)23(3828)1419101120(3719)15362212918(29)1321(22)30h41425H315H212H3b2314
MFCD02374391
ZINC000002108934
ZINC000002108940
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