Vitas-M small molecule compound
methyl 2-[(3E)-3-[hydroxy(4-methoxy-3-methylphenyl)methylidene]-2-(3-methoxyphenyl)-4,5-dioxopyrrolidin-1-yl]-4-methyl-1,3-thiazole-5-carboxylate
Catalog ID
STL046374
SMILES COc1cccc(c1)C1/C(=C(/c2ccc(c(c2)C)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 C26H24N2O7S MW 508.55 g/mol Purity >90% as per NMR
InChI
InChI=1S/C26H24N2O7S/c1-13-11-16(9-10-18(13)34-4)21(29)19-20(15-7-6-8-17(12-15)33-3)28(24(31)22(19)30)26-27-14(2)23(36-26)25(32)35-5/h6-12,20,29H,1-5H3/b21-19+InChIKey
VALSNQBYWFCEQY-XUTLUUPISA-NSynonyms
636987-92-3636987923
CC1=C(C=CC(=C1)C(=C2C(N(C(=O)C2=O)C3=NC(=C(S3)C(=O)OC)C)C4=CC(=CC=C4)OC)O)OC
COc1cccc(c1)C1C(=C(c2ccc(c(c2)C)OC)O)C(=O)C(=O)N1c1sc(c(n1)C)C(=O)OC
InChI=1SC26H24N2O7Sc1131116(91018(13)344)21(29)1920(1576817(1215)333)28(24(31)22(19)30)262714(2)23(3626)25(32)355h6122029H15H3b2119+
methyl2((3E)3(hydroxy(4methoxy3methylphenyl)methylidene)2(3methoxyphenyl)45dioxopyrrolidin1yl)4methyl13thiazole5carboxylate
METHYL2(3HYDROXY4((4METHOXY3METHYLPHENYL)CARBONYL)5(3METHOXYPHENYL)2OXO(3PYRROLINYL))4METHYL13THIAZOLE5CARBOXYLATE
MFCD03803942
ZINC000102881131
ZINC000102881134
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