Vitas-M small molecule compound
methyl 2-[(3E)-3-[hydroxy(3-methoxyphenyl)methylidene]-4,5-dioxo-2-(4-propoxyphenyl)pyrrolidin-1-yl]-4-methyl-1,3-thiazole-5-carboxylate
Catalog ID
STK605553
SMILES CCCOc1ccc(cc1)C1/C(=C(/c2cccc(c2)OC)\O)/C(=O)C(=O)N1c1sc(c(n1)C)C(=O)OC
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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 C27H26N2O7S MW 522.58 g/mol Purity >90% as per NMR
InChI
InChI=1S/C27H26N2O7S/c1-5-13-36-18-11-9-16(10-12-18)21-20(22(30)17-7-6-8-19(14-17)34-3)23(31)25(32)29(21)27-28-15(2)24(37-27)26(33)35-4/h6-12,14,21,30H,5,13H2,1-4H3/b22-20+InChIKey
LVNGZVRYPAMHDT-LSDHQDQOSA-NSynonyms
609307-62-2609307622
CCCOC1=CC=C(C=C1)C2C(=C(C3=CC(=CC=C3)OC)O)C(=O)C(=O)N2C4=NC(=C(S4)C(=O)OC)C
CCCOc1ccc(cc1)C1C(=C(c2cccc(c2)OC)O)C(=O)C(=O)N1c1sc(c(n1)C)C(=O)OC
InChI=1SC27H26N2O7Sc1513361811916(101218)2120(22(30)1776819(1417)343)23(31)25(32)29(21)272815(2)24(3727)26(33)354h612142130H513H214H3b2220+
methyl2((3E)3(hydroxy(3methoxyphenyl)methylidene)45dioxo2(4propoxyphenyl)pyrrolidin1yl)4methyl13thiazole5carboxylate
METHYL2((4E)4(HYDROXY(3METHOXYPHENYL)METHYLIDENE)23DIOXO5(4PROPOXYPHENYL)PYRROLIDIN1YL)4METHYL13THIAZOLE5CARBOXYLATE
METHYL2(3HYDROXY4((3METHOXYPHENYL)CARBONYL)2OXO5(4PROPOXYPHENYL)(3PYRROLINYL))4METHYL13THIAZOLE5CARBOXYLATE
MFCD08733103
ZINC000102699058
ZINC000102699065
Check stock
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Check stock on Vitas-MAvailable files
Download the SDF, MOL, 3D structure and SDS documents from Vitas-M.