Vitas-M small molecule compound
methyl (2Z)-2-{4-methoxy-3-[(2,3,5,6-tetrafluorophenoxy)methyl]benzylidene}-7-methyl-3-oxo-5-phenyl-2,3-dihydro-5H-[1,3]thiazolo[3,2-a]pyrimidine-6-carboxylate
Catalog ID
STL173651
SMILES COC(=O)C1=C(C)N=c2n(C1c1ccccc1)c(=O)/c(=C/c1ccc(c(c1)COc1c(F)c(F)cc(c1F)F)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 C30H22F4N2O5S MW 598.57 g/mol Purity >90% as per NMR
InChI
InChI=1S/C30H22F4N2O5S/c1-15-23(29(38)40-3)26(17-7-5-4-6-8-17)36-28(37)22(42-30(36)35-15)12-16-9-10-21(39-2)18(11-16)14-41-27-24(33)19(31)13-20(32)25(27)34/h4-13,26H,14H2,1-3H3/b22-12-InChIKey
IRTDRLUPQLQBGM-UUYOSTAYSA-NSynonyms
445036-30-6445036306
CC1=C(C(N2C(=O)C(=CC3=CC(=C(C=C3)OC)COC4=C(C(=CC(=C4F)F)F)F)SC2=N1)C5=CC=CC=C5)C(=O)OC
COC(=O)C1=C(C)N=c2n(C1c1ccccc1)c(=O)c(=Cc1ccc(c(c1)COc1c(F)c(F)cc(c1F)F)OC)s2
InChI=1SC30H22F4N2O5Sc11523(29(38)403)26(177546817)3628(37)22(4230(36)3515)121691021(392)18(1116)14412724(33)19(31)1320(32)25(27)34h41326H14H213H3b2212
methyl(2Z)2((4methoxy3((2356tetrafluorophenoxy)methyl)phenyl)methylidene)7methyl3oxo5phenyl5H(13)thiazolo(32a)pyrimidine6carboxylate
methyl(2Z)2(4methoxy3((2356tetrafluorophenoxy)methyl)benzylidene)7methyl3oxo5phenyl23dihydro5H(13)thiazolo(32a)pyrimidine6carboxylate
MFCD02243331
ZINC000002107534
ZINC000002107538
Check stock
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Check stock on Vitas-MAvailable files
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