Vitas-M small molecule compound
phenyl (2E)-2-[3-methoxy-4-(2-phenoxyethoxy)benzylidene]-7-methyl-3-oxo-5-phenyl-2,3-dihydro-5H-[1,3]thiazolo[3,2-a]pyrimidine-6-carboxylate
Catalog ID
STK019179
SMILES COc1cc(ccc1OCCOc1ccccc1)/C=c\1/sc2=NC(=C(C(n2c1=O)c1ccccc1)C(=O)Oc1ccccc1)C
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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 C36H30N2O6S MW 618.71 g/mol Purity >90% as per NMR
InChI
InChI=1S/C36H30N2O6S/c1-24-32(35(40)44-28-16-10-5-11-17-28)33(26-12-6-3-7-13-26)38-34(39)31(45-36(38)37-24)23-25-18-19-29(30(22-25)41-2)43-21-20-42-27-14-8-4-9-15-27/h3-19,22-23,33H,20-21H2,1-2H3/b31-23+InChIKey
UAFKDMLXNISJME-UQRQXUALSA-NSynonyms
CC1=C(C(N2C(=O)C(=CC3=CC(=C(C=C3)OCCOC4=CC=CC=C4)OC)SC2=N1)C5=CC=CC=C5)C(=O)OC6=CC=CC=C6
COc1cc(ccc1OCCOc1ccccc1)C=c1sc2=NC(=C(C(n2c1=O)c1ccccc1)C(=O)Oc1ccccc1)C
InChI=1SC36H30N2O6Sc12432(35(40)442816105111728)33(26126371326)3834(39)31(4536(38)3724)2325181929(30(2225)412)4321204227148491527h319222333H2021H212H3b3123+
MFCD08049774
phenyl(2E)2((3methoxy4(2phenoxyethoxy)phenyl)methylidene)7methyl3oxo5phenyl5H(13)thiazolo(32a)pyrimidine6carboxylate
PHENYL(2E)2(3METHOXY4(2PHENOXYETHOXY)BENZYLIDENE)7METHYL3OXO5PHENYL23DIHYDRO5H(13)THIAZOLO(32A)PYRIMIDINE6CARBOXYLATE
STK019179
ZINC000097958008
ZINC000097958009
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