Vitas-M small molecule compound
ethyl (2Z)-2-[(3,5-dimethyl-1-phenyl-1H-pyrazol-4-yl)methylidene]-7-methyl-3-oxo-5-phenyl-2,3-dihydro-5H-[1,3]thiazolo[3,2-a]pyrimidine-6-carboxylate
Catalog ID
STL391441
SMILES CCOC(=O)C1=C(C)N=c2n(C1c1ccccc1)c(=O)/c(=C/c1c(C)nn(c1C)c1ccccc1)/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 C28H26N4O3S MW 498.61 g/mol Purity >90% as per NMR
InChI
InChI=1S/C28H26N4O3S/c1-5-35-27(34)24-18(3)29-28-31(25(24)20-12-8-6-9-13-20)26(33)23(36-28)16-22-17(2)30-32(19(22)4)21-14-10-7-11-15-21/h6-16,25H,5H2,1-4H3/b23-16-InChIKey
JYFWQLWQLFBEFF-KQWNVCNZSA-NSynonyms
492427-46-0492427460
CCOC(=O)C1=C(C)N=c2n(C1c1ccccc1)c(=O)c(=Cc1c(C)nn(c1C)c1ccccc1)s2
CCOC(=O)C1=C(N=C2N(C1C3=CC=CC=C3)C(=O)C(=CC4=C(N(N=C4C)C5=CC=CC=C5)C)S2)C
ethyl(2Z)2((35dimethyl1phenyl1Hpyrazol4yl)methylidene)7methyl3oxo5phenyl23dihydro5H(13)thiazolo(32a)pyrimidine6carboxylate
ETHYL(2Z)2((35DIMETHYL1PHENYLPYRAZOL4YL)METHYLIDENE)7METHYL3OXO5PHENYL5H(13)THIAZOLO(32A)PYRIMIDINE6CARBOXYLATE
ETHYL2((35DIMETHYL1PHENYL1HPYRAZOL4YL)METHYLENE)7METHYL3OXO5PHENYL23DIHYDRO5H(13)THIAZOLO(32A)PYRIMIDINE6CARBOXYLATE
InChI=1SC28H26N4O3Sc153527(34)2418(3)292831(25(24)20128691320)26(33)23(3628)162217(2)3032(19(22)4)2114107111521h61625H5H214H3b2316
MFCD02243163
ZINC000002106152
ZINC000002106157
Check stock
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Check stock on Vitas-MAvailable files
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