Vitas-M small molecule compound
(E)-(4-ethoxyphenyl){1-[3-(1H-imidazol-3-ium-1-yl)propyl]-2-(3-methoxy-4-propoxyphenyl)-4,5-dioxopyrrolidin-3-ylidene}methanolate
Catalog ID
STL149379
SMILES CCCOc1ccc(cc1OC)C1/C(=C(/c2ccc(cc2)OCC)\[O-])/C(=O)C(=O)N1CCCn1cc[nH+]c1
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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 C29H33N3O6 MW 519.60 g/mol Purity >90% as per NMR
InChI
InChI=1S/C29H33N3O6/c1-4-17-38-23-12-9-21(18-24(23)36-3)26-25(27(33)20-7-10-22(11-8-20)37-5-2)28(34)29(35)32(26)15-6-14-31-16-13-30-19-31/h7-13,16,18-19,26,33H,4-6,14-15,17H2,1-3H3/b27-25+InChIKey
SIYVGCVFMQXVEV-IMVLJIQESA-NSynonyms
636987-98-9(4E)4((4ETHOXYPHENYL)HYDROXYMETHYLIDENE)1(3IMIDAZOL1YLPROPYL)5(3METHOXY4PROPOXYPHENYL)PYRROLIDINE23DIONE
(E)(4ethoxyphenyl)(1(3(1Himidazol3ium1yl)propyl)2(3methoxy4propoxyphenyl)45dioxopyrrolidin3ylidene)methanolate
4((4ETHOXYPHENYL)CARBONYL)3HYDROXY1(3IMIDAZOLYLPROPYL)5(3METHOXY4PROPOXYPHENYL)3PYRROLIN2ONE
636987989
CCCOC1=C(C=C(C=C1)C2C(=C(C3=CC=C(C=C3)OCC)O)C(=O)C(=O)N2CCCN4C=CN=C4)OC
CCCOc1ccc(cc1OC)C1C(=C(c2ccc(cc2)OCC)(O))C(=O)C(=O)N1CCCn1cc(nH+)c1
InChI=1SC29H33N3O6c1417382312921(1824(23)363)2625(27(33)2071022(11820)3752)28(34)29(35)32(26)15614311613301931h7131618192633H46141517H213H3b2725+
MFCD20755594
ZINC000102929180
ZINC000102929182
Check stock
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