Vitas-M small molecule compound
methyl (2E)-5-[4-(dimethylamino)phenyl]-2-[(1-ethyl-1H-pyrazol-4-yl)methylidene]-7-methyl-3-oxo-2,3-dihydro-5H-[1,3]thiazolo[3,2-a]pyrimidine-6-carboxylate
Catalog ID
STK309205
SMILES COC(=O)C1=C(C)N=c2n(C1c1ccc(cc1)N(C)C)c(=O)/c(=C\c1cnn(c1)CC)/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 C23H25N5O3S MW 451.55 g/mol Purity >90% as per NMR
InChI
InChI=1S/C23H25N5O3S/c1-6-27-13-15(12-24-27)11-18-21(29)28-20(16-7-9-17(10-8-16)26(3)4)19(22(30)31-5)14(2)25-23(28)32-18/h7-13,20H,6H2,1-5H3/b18-11+InChIKey
XDRIRKFPNIDLNZ-WOJGMQOQSA-NSynonyms
1005692-63-61005692636
CCN1C=C(C=N1)C=C2C(=O)N3C(C(=C(N=C3S2)C)C(=O)OC)C4=CC=C(C=C4)N(C)C
COC(=O)C1=C(C)N=c2n(C1c1ccc(cc1)N(C)C)c(=O)c(=Cc1cnn(c1)CC)s2
InChI=1SC23H25N5O3Sc16271315(122427)111821(29)2820(167917(10816)26(3)4)19(22(30)315)14(2)2523(28)3218h71320H6H215H3b1811+
methyl(2E)5(4(dimethylamino)phenyl)2((1ethyl1Hpyrazol4yl)methylidene)7methyl3oxo23dihydro5H(13)thiazolo(32a)pyrimidine6carboxylate
methyl(2E)5(4(dimethylamino)phenyl)2((1ethylpyrazol4yl)methylidene)7methyl3oxo5H(13)thiazolo(32a)pyrimidine6carboxylate
METHYL(2E)5(4DIMETHYLAMINOPHENYL)2((1ETHYLPYRAZOL4YL)METHYLIDENE)7METHYL3OXO5H(13)THIAZOLO(32A)PYRIMIDINE6CARBOXYLATE
MFCD04052486
ZINC000013959965
ZINC000013959966
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Check stock on Vitas-MAvailable files
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