Vitas-M small molecule compound
methyl 2-[(3E)-3-[(4-butoxyphenyl)(hydroxy)methylidene]-4,5-dioxo-2-(pyridin-3-yl)pyrrolidin-1-yl]-4-methyl-1,3-thiazole-5-carboxylate
Catalog ID
STL057491
SMILES CCCCOc1ccc(cc1)/C(=C/1\C(=O)C(=O)N(C1c1cccnc1)c1nc(c(s1)C(=O)OC)C)/O
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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 C26H25N3O6S MW 507.57 g/mol Purity >90% as per NMR
InChI
InChI=1S/C26H25N3O6S/c1-4-5-13-35-18-10-8-16(9-11-18)21(30)19-20(17-7-6-12-27-14-17)29(24(32)22(19)31)26-28-15(2)23(36-26)25(33)34-3/h6-12,14,20,30H,4-5,13H2,1-3H3/b21-19+InChIKey
AOKLAPHTNLBCGV-XUTLUUPISA-NSynonyms
CCCCOC1=CC=C(C=C1)C(=C2C(N(C(=O)C2=O)C3=NC(=C(S3)C(=O)OC)C)C4=CN=CC=C4)O
CCCCOc1ccc(cc1)C(=C1C(=O)C(=O)N(C1c1cccnc1)c1nc(c(s1)C(=O)OC)C)O
InChI=1SC26H25N3O6Sc14513351810816(91118)21(30)1920(177612271417)29(24(32)22(19)31)262815(2)23(3626)25(33)343h612142030H4513H213H3b2119+
methyl2((3E)3((4butoxyphenyl)(hydroxy)methylidene)45dioxo2(pyridin3yl)pyrrolidin1yl)4methyl13thiazole5carboxylate
METHYL2((4E)4((4BUTOXYPHENYL)HYDROXYMETHYLIDENE)23DIOXO5PYRIDIN3YLPYRROLIDIN1YL)4METHYL13THIAZOLE5CARBOXYLATE
METHYL2(3(4BUTOXYBENZOYL)4HYDROXY5OXO2(PYRIDIN3YL)25DIHYDRO1HPYRROL1YL)4METHYLTHIAZOLE5CARBOXYLATE
MFCD05737978
ZINC000102897530
ZINC000102897531
Check stock
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Check stock on Vitas-MAvailable files
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