Vitas-M small molecule compound
(E)-{1-[2-(morpholin-4-ium-4-yl)ethyl]-4,5-dioxo-2-[4-(propan-2-yl)phenyl]pyrrolidin-3-ylidene}[4-(propan-2-yloxy)phenyl]methanolate
Catalog ID
STK561142
SMILES CC(Oc1ccc(cc1)/C(=C/1\C(=O)C(=O)N(C1c1ccc(cc1)C(C)C)CC[NH+]1CCOCC1)/[O-])C
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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 C29H36N2O5 MW 492.62 g/mol Purity >90% as per NMR
InChI
InChI=1S/C29H36N2O5/c1-19(2)21-5-7-22(8-6-21)26-25(27(32)23-9-11-24(12-10-23)36-20(3)4)28(33)29(34)31(26)14-13-30-15-17-35-18-16-30/h5-12,19-20,26,32H,13-18H2,1-4H3/b27-25+InChIKey
YUANQLKVSOLZQV-IMVLJIQESA-NSynonyms
371232-85-8(4E)4(HYDROXY(4PROPAN2YLOXYPHENYL)METHYLIDENE)1(2MORPHOLIN4YLETHYL)5(4PROPAN2YLPHENYL)PYRROLIDINE23DIONE
(E)(1(2(morpholin4ium4yl)ethyl)45dioxo2(4(propan2yl)phenyl)pyrrolidin3ylidene)(4(propan2yloxy)phenyl)methanolate
(E)(1(2MORPHOLIN4IUM4YLETHYL)45DIOXO2(4PROPAN2YLPHENYL)PYRROLIDIN3YLIDENE)(4PROPAN2YLOXYPHENYL)METHANOLATE
371232858
3HYDROXY4((4(METHYLETHOXY)PHENYL)CARBONYL)5(4(METHYLETHYL)PHENYL)1(2MORPHOLIN4YLETHYL)3PYRROLIN2ONE
CC(C)C1=CC=C(C=C1)C2C(=C(C3=CC=C(C=C3)OC(C)C)O)C(=O)C(=O)N2CCN4CCOCC4
CC(Oc1ccc(cc1)C(=C1C(=O)C(=O)N(C1c1ccc(cc1)C(C)C)CC(NH+)1CCOCC1)(O))C
InChI=1SC29H36N2O5c119(2)215722(8621)2625(27(32)2391124(121023)3620(3)4)28(33)29(34)31(26)141330151735181630h51219202632H1318H214H3b2725+
MFCD18243718
ZINC000008818198
ZINC000008818199
Check stock
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Check stock on Vitas-MAvailable files
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