Vitas-M small molecule compound

(E)-{1-[2-(diethylammonio)ethyl]-4,5-dioxo-2-[4-(propan-2-yloxy)phenyl]pyrrolidin-3-ylidene}(4-propoxyphenyl)methanolate

Catalog ID
STL147902
SMILES CCCOc1ccc(cc1)/C(=C/1\C(=O)C(=O)N(C1c1ccc(cc1)OC(C)C)CC[NH+](CC)CC)/[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 C29H38N2O5 MW 494.63 g/mol Purity >90% as per NMR
InChI
InChI=1S/C29H38N2O5/c1-6-19-35-23-13-11-22(12-14-23)27(32)25-26(21-9-15-24(16-10-21)36-20(4)5)31(29(34)28(25)33)18-17-30(7-2)8-3/h9-16,20,26,32H,6-8,17-19H2,1-5H3/b27-25+
InChIKey
MHDOTHGEJCKMKY-IMVLJIQESA-N
Synonyms
848061-70-1
(4E)1(2(diethylamino)ethyl)4(hydroxy(4propoxyphenyl)methylidene)5(4propan2yloxyphenyl)pyrrolidine23dione
(4E)1(2DIETHYLAMINOETHYL)4(HYDROXY(4PROPOXYPHENYL)METHYLIDENE)5(4PROPAN2YLOXYPHENYL)PYRROLIDINE23DIONE
(E)(1(2(diethylammonio)ethyl)45dioxo2(4(propan2yloxy)phenyl)pyrrolidin3ylidene)(4propoxyphenyl)methanolate
(E)(1(2(DIETHYLAZANIUMYL)ETHYL)45DIOXO2(4PROPAN2YLOXYPHENYL)PYRROLIDIN3YLIDENE)(4PROPOXYPHENYL)METHANOLATE
1(2(DIETHYLAMINO)ETHYL)3HYDROXY5(4(METHYLETHOXY)PHENYL)4((4PROPOXYPHENYL)CARBONYL)3PYRROLIN2ONE
848061701
CCCOC1=CC=C(C=C1)C(=C2C(N(C(=O)C2=O)CCN(CC)CC)C3=CC=C(C=C3)OC(C)C)O
CCCOc1ccc(cc1)C(=C1C(=O)C(=O)N(C1c1ccc(cc1)OC(C)C)CC(NH+)(CC)CC)(O)
InChI=1SC29H38N2O5c16193523131122(121423)27(32)2526(2191524(161021)3620(4)5)31(29(34)28(25)33)181730(72)83h916202632H681719H215H3b2725+
MFCD20755284
ZINC000102925850
ZINC000102925853

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Available files

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