Vitas-M small molecule compound
(E)-{2-(4-methylphenyl)-1-[2-(morpholin-4-ium-4-yl)ethyl]-4,5-dioxopyrrolidin-3-ylidene}(phenyl)methanolate
Catalog ID
STL039412
SMILES Cc1ccc(cc1)C1N(CC[NH+]2CCOCC2)C(=O)C(=O)/C/1=C(\c1ccccc1)/[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 C24H26N2O4 MW 406.48 g/mol Purity >90% as per NMR
InChI
InChI=1S/C24H26N2O4/c1-17-7-9-18(10-8-17)21-20(22(27)19-5-3-2-4-6-19)23(28)24(29)26(21)12-11-25-13-15-30-16-14-25/h2-10,21,27H,11-16H2,1H3/b22-20+InChIKey
KZUUSLLVYBXGMB-LSDHQDQOSA-NSynonyms
(4E)4(HYDROXY(PHENYL)METHYLIDENE)5(4METHYLPHENYL)1(2MORPHOLIN4YLETHYL)PYRROLIDINE23DIONE
(E)(2(4methylphenyl)1(2(morpholin4ium4yl)ethyl)45dioxopyrrolidin3ylidene)(phenyl)methanolate
(E)(2(4METHYLPHENYL)1(2MORPHOLIN4IUM4YLETHYL)45DIOXOPYRROLIDIN3YLIDENE)PHENYLMETHANOLATE
CC1=CC=C(C=C1)C2C(=C(C3=CC=CC=C3)O)C(=O)C(=O)N2CCN4CCOCC4
Cc1ccc(cc1)C1N(CC(NH+)2CCOCC2)C(=O)C(=O)C1=C(c1ccccc1)(O)
InChI=1SC24H26N2O4c1177918(10817)2120(22(27)195324619)23(28)24(29)26(21)121125131530161425h2102127H1116H21H3b2220+
MFCD18247830
ZINC000005446330
ZINC000102863348
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