Vitas-M small molecule compound
methyl 2-{(3E)-2-(3-hydroxyphenyl)-3-[hydroxy(4-propoxyphenyl)methylidene]-4,5-dioxopyrrolidin-1-yl}-4-methyl-1,3-thiazole-5-carboxylate
Catalog ID
STL037526
SMILES CCCOc1ccc(cc1)/C(=C/1\C(=O)C(=O)N(C1c1cccc(c1)O)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 C26H24N2O7S MW 508.55 g/mol Purity >90% as per NMR
InChI
InChI=1S/C26H24N2O7S/c1-4-12-35-18-10-8-15(9-11-18)21(30)19-20(16-6-5-7-17(29)13-16)28(24(32)22(19)31)26-27-14(2)23(36-26)25(33)34-3/h5-11,13,20,29-30H,4,12H2,1-3H3/b21-19+InChIKey
MDMBAKKAGDQQDR-XUTLUUPISA-NSynonyms
636989-58-7636989587
CCCOC1=CC=C(C=C1)C(=C2C(N(C(=O)C2=O)C3=NC(=C(S3)C(=O)OC)C)C4=CC(=CC=C4)O)O
CCCOc1ccc(cc1)C(=C1C(=O)C(=O)N(C1c1cccc(c1)O)c1nc(c(s1)C(=O)OC)C)O
InChI=1SC26H24N2O7Sc1412351810815(91118)21(30)1920(1665717(29)1316)28(24(32)22(19)31)262714(2)23(3626)25(33)343h51113202930H412H213H3b2119+
methyl2((3E)2(3hydroxyphenyl)3(hydroxy(4propoxyphenyl)methylidene)45dioxopyrrolidin1yl)4methyl13thiazole5carboxylate
METHYL2(3HYDROXY5(3HYDROXYPHENYL)2OXO4((4PROPOXYPHENYL)CARBONYL)(3PYRROLINYL))4METHYL13THIAZOLE5CARBOXYLATE
MFCD03809054
ZINC000102858149
ZINC000102858154
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