Vitas-M small molecule compound
(E)-{1-[2-(dimethylammonio)ethyl]-2-(4-ethoxyphenyl)-4,5-dioxopyrrolidin-3-ylidene}(5-methyl-1-phenyl-1H-pyrazol-4-yl)methanolate
Catalog ID
STL038541
SMILES CCOc1ccc(cc1)C1N(CC[NH+](C)C)C(=O)C(=O)/C/1=C(\c1cnn(c1C)c1ccccc1)/[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 C27H30N4O4 MW 474.56 g/mol Purity >90% as per NMR
InChI
InChI=1S/C27H30N4O4/c1-5-35-21-13-11-19(12-14-21)24-23(26(33)27(34)30(24)16-15-29(3)4)25(32)22-17-28-31(18(22)2)20-9-7-6-8-10-20/h6-14,17,24,32H,5,15-16H2,1-4H3/b25-23+InChIKey
CDTJGZKNILRFNZ-WJTDDFOZSA-NSynonyms
955898-96-1(4E)1(2DIMETHYLAMINOETHYL)5(4ETHOXYPHENYL)4(HYDROXY(5METHYL1PHENYLPYRAZOL4YL)METHYLIDENE)PYRROLIDINE23DIONE
(E)(1(2(dimethylammonio)ethyl)2(4ethoxyphenyl)45dioxopyrrolidin3ylidene)(5methyl1phenyl1Hpyrazol4yl)methanolate
(E)(1(2(DIMETHYLAZANIUMYL)ETHYL)2(4ETHOXYPHENYL)45DIOXOPYRROLIDIN3YLIDENE)(5METHYL1PHENYLPYRAZOL4YL)METHANOLATE
1(2(DIMETHYLAMINO)ETHYL)5(4ETHOXYPHENYL)3HYDROXY4((5METHYL1PHENYLPYRAZOL4YL)CARBONYL)3PYRROLIN2ONE
955898961
CCOC1=CC=C(C=C1)C2C(=C(C3=C(N(N=C3)C4=CC=CC=C4)C)(O))C(=O)C(=O)N2CC(NH+)(C)C
CCOc1ccc(cc1)C1N(CC(NH+)(C)C)C(=O)C(=O)C1=C(c1cnn(c1C)c1ccccc1)(O)
InChI=1SC27H30N4O4c153521131119(121421)2423(26(33)27(34)30(24)161529(3)4)25(32)22172831(18(22)2)2097681020h614172432H51516H214H3b2523+
MFCD18247650
ZINC000102861554
ZINC000102861561
Check stock
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Check stock on Vitas-MAvailable files
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