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(E)-(3-chloro-4-methoxyphenyl){1-[3-(morpholin-4-ium-4-yl)propyl]-4,5-dioxo-2-(thiophen-2-yl)pyrrolidin-3-ylidene}methanolate

Catalog ID
STL150011
SMILES COc1ccc(cc1Cl)/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 C23H25ClN2O5S MW 476.98 g/mol Purity >90% as per NMR
InChI
InChI=1S/C23H25ClN2O5S/c1-30-17-6-5-15(14-16(17)24)21(27)19-20(18-4-2-13-32-18)26(23(29)22(19)28)8-3-7-25-9-11-31-12-10-25/h2,4-6,13-14,20,27H,3,7-12H2,1H3/b21-19+
InChIKey
YFZDRQBINOFQKM-XUTLUUPISA-N
Synonyms
847181-96-8
(4E)4((3CHLORO4METHOXYPHENYL)HYDROXYMETHYLIDENE)1(3MORPHOLIN4YLPROPYL)5THIOPHEN2YLPYRROLIDINE23DIONE
(4Z)4((3CHLORO4METHOXYPHENYL)HYDROXYMETHYLIDENE)1(3MORPHOLIN4YLPROPYL)5THIOPHEN2YLPYRROLIDINE23DIONE
(E)(3chloro4methoxyphenyl)(1(3(morpholin4ium4yl)propyl)45dioxo2(thiophen2yl)pyrrolidin3ylidene)methanolate
(E)(3CHLORO4METHOXYPHENYL)(1(3MORPHOLIN4IUM4YLPROPYL)45DIOXO2THIOPHEN2YLPYRROLIDIN3YLIDENE)METHANOLATE
4((3CHLORO4METHOXYPHENYL)CARBONYL)3HYDROXY1(3MORPHOLIN4YLPROPYL)5(2THIENYL)3PYRROLIN2ONE
4(3CHLORO4METHOXYBENZOYL)3HYDROXY1(3(4MORPHOLINYL)PROPYL)5(2THIENYL)15DIHYDRO2HPYRROL2ONE
847181968
COC1=C(C=C(C=C1)C(=C2C(N(C(=O)C2=O)CCCN3CCOCC3)C4=CC=CS4)O)Cl
COc1ccc(cc1Cl)C(=C1C(=O)C(=O)N(C1c1cccs1)CCC(NH+)1CCOCC1)(O)
InChI=1SC23H25ClN2O5Sc130176515(1416(17)24)21(27)1920(1842133218)26(23(29)22(19)28)8372591131121025h24613142027H3712H21H3b2119+
MFCD20755720
ZINC000102930468
ZINC000102930469

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Available files

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