Vitas-M small molecule compound
(E)-{1-[2-(dimethylammonio)ethyl]-4,5-dioxo-2-(3-phenoxyphenyl)pyrrolidin-3-ylidene}[4-(propan-2-yloxy)phenyl]methanolate
Catalog ID
STL055793
SMILES CC(Oc1ccc(cc1)/C(=C/1\C(=O)C(=O)N(C1c1cccc(c1)Oc1ccccc1)CC[NH+](C)C)/[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 C30H32N2O5 MW 500.59 g/mol Purity >90% as per NMR
InChI
InChI=1S/C30H32N2O5/c1-20(2)36-24-15-13-21(14-16-24)28(33)26-27(32(18-17-31(3)4)30(35)29(26)34)22-9-8-12-25(19-22)37-23-10-6-5-7-11-23/h5-16,19-20,27,33H,17-18H2,1-4H3/b28-26+InChIKey
YZBASRXFNLRIFC-BYCLXTJYSA-NSynonyms
459182-17-3(4E)1(2(dimethylamino)ethyl)4(hydroxy(4propan2yloxyphenyl)methylidene)5(3phenoxyphenyl)pyrrolidine23dione
(4E)1(2DIMETHYLAMINOETHYL)4(HYDROXY(4PROPAN2YLOXYPHENYL)METHYLIDENE)5(3PHENOXYPHENYL)PYRROLIDINE23DIONE
(E)(1(2(dimethylammonio)ethyl)45dioxo2(3phenoxyphenyl)pyrrolidin3ylidene)(4(propan2yloxy)phenyl)methanolate
(E)(1(2(DIMETHYLAZANIUMYL)ETHYL)45DIOXO2(3PHENOXYPHENYL)PYRROLIDIN3YLIDENE)(4PROPAN2YLOXYPHENYL)METHANOLATE
459182173
CC(C)OC1=CC=C(C=C1)C(=C2C(N(C(=O)C2=O)CCN(C)C)C3=CC(=CC=C3)OC4=CC=CC=C4)O
CC(Oc1ccc(cc1)C(=C1C(=O)C(=O)N(C1c1cccc(c1)Oc1ccccc1)CC(NH+)(C)C)(O))C
InChI=1SC30H32N2O5c120(2)3624151321(141624)28(33)2627(32(181731(3)4)30(35)29(26)34)22981225(1922)3723106571123h51619202733H1718H214H3b2826+
MFCD18249702
ZINC000102369012
ZINC000102369017
Check stock
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Check stock on Vitas-MAvailable files
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