Vitas-M small molecule compound
methyl (2E)-5-[4-(dimethylamino)phenyl]-2-[(1-ethyl-1H-pyrazol-3-yl)methylidene]-7-methyl-3-oxo-2,3-dihydro-5H-[1,3]thiazolo[3,2-a]pyrimidine-6-carboxylate
Catalog ID
STL403843
SMILES COC(=O)C1=C(C)N=c2n(C1c1ccc(cc1)N(C)C)c(=O)/c(=C\c1ccn(n1)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/c1-6-27-12-11-16(25-27)13-18-21(29)28-20(15-7-9-17(10-8-15)26(3)4)19(22(30)31-5)14(2)24-23(28)32-18/h7-13,20H,6H2,1-5H3/b18-13+InChIKey
INQSRRJNLARKRW-QGOAFFKASA-NSynonyms
1005645-33-91005645339
CCN1C=CC(=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(=Cc1ccn(n1)CC)s2
InChI=1SC23H25N5O3Sc1627121116(2527)131821(29)2820(157917(10815)26(3)4)19(22(30)315)14(2)2423(28)3218h71320H6H215H3b1813+
methyl(2E)5(4(dimethylamino)phenyl)2((1ethyl1Hpyrazol3yl)methylidene)7methyl3oxo23dihydro5H(13)thiazolo(32a)pyrimidine6carboxylate
methyl(2E)5(4(dimethylamino)phenyl)2((1ethylpyrazol3yl)methylidene)7methyl3oxo5H(13)thiazolo(32a)pyrimidine6carboxylate
METHYL(2E)5(4DIMETHYLAMINOPHENYL)2((1ETHYLPYRAZOL3YL)METHYLIDENE)7METHYL3OXO5H(13)THIAZOLO(32A)PYRIMIDINE6CARBOXYLATE
MFCD04045971
ZINC000022532404
ZINC000022532409
Check stock
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Check stock on Vitas-MAvailable files
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