Vitas-M small molecule compound
(E)-{1-[3-(morpholin-4-ium-4-yl)propyl]-4,5-dioxo-2-(thiophen-2-yl)pyrrolidin-3-ylidene}(4-propoxyphenyl)methanolate
Catalog ID
STL151144
SMILES CCCOc1ccc(cc1)/C(=C/1\C(=O)C(=O)N(C1c1cccs1)CCC[NH+]1CCOCC1)/[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 C25H30N2O5S MW 470.59 g/mol Purity >90% as per NMR
InChI
InChI=1S/C25H30N2O5S/c1-2-14-32-19-8-6-18(7-9-19)23(28)21-22(20-5-3-17-33-20)27(25(30)24(21)29)11-4-10-26-12-15-31-16-13-26/h3,5-9,17,22,28H,2,4,10-16H2,1H3/b23-21+InChIKey
FXVHJHBLNHGXDM-XTQSDGFTSA-NSynonyms
615276-00-1(4E)4(HYDROXY(4PROPOXYPHENYL)METHYLIDENE)1(3MORPHOLIN4YLPROPYL)5THIOPHEN2YLPYRROLIDINE23DIONE
(4Z)4(HYDROXY(4PROPOXYPHENYL)METHYLIDENE)1(3MORPHOLIN4YLPROPYL)5THIOPHEN2YLPYRROLIDINE23DIONE
(E)(1(3(morpholin4ium4yl)propyl)45dioxo2(thiophen2yl)pyrrolidin3ylidene)(4propoxyphenyl)methanolate
(E)(1(3MORPHOLIN4IUM4YLPROPYL)45DIOXO2THIOPHEN2YLPYRROLIDIN3YLIDENE)(4PROPOXYPHENYL)METHANOLATE
3HYDROXY1(3MORPHOLIN4YLPROPYL)4((4PROPOXYPHENYL)CARBONYL)5(2THIENYL)3PYRROLIN2ONE
615276001
CCCOC1=CC=C(C=C1)C(=C2C(N(C(=O)C2=O)CCCN3CCOCC3)C4=CC=CS4)O
CCCOc1ccc(cc1)C(=C1C(=O)C(=O)N(C1c1cccs1)CCC(NH+)1CCOCC1)(O)
InChI=1SC25H30N2O5Sc121432198618(7919)23(28)2122(2053173320)27(25(30)24(21)29)1141026121531161326h359172228H241016H21H3b2321+
MFCD20755988
ZINC000102932681
ZINC000102932685
Check stock
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Check stock on Vitas-MAvailable files
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