Vitas-M small molecule compound
(E)-{2-(4-methoxyphenyl)-1-[3-(morpholin-4-ium-4-yl)propyl]-4,5-dioxopyrrolidin-3-ylidene}(5-methyl-1-phenyl-1H-pyrazol-4-yl)methanolate
Catalog ID
STK561295
SMILES COc1ccc(cc1)C1N(CCC[NH+]2CCOCC2)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 C29H32N4O5 MW 516.60 g/mol Purity >90% as per NMR
InChI
InChI=1S/C29H32N4O5/c1-20-24(19-30-33(20)22-7-4-3-5-8-22)27(34)25-26(21-9-11-23(37-2)12-10-21)32(29(36)28(25)35)14-6-13-31-15-17-38-18-16-31/h3-5,7-12,19,26,34H,6,13-18H2,1-2H3/b27-25+InChIKey
ORETYQPZSMNGAR-IMVLJIQESA-NSynonyms
955865-35-7(4E)4(HYDROXY(5METHYL1PHENYLPYRAZOL4YL)METHYLIDENE)5(4METHOXYPHENYL)1(3MORPHOLIN4YLPROPYL)PYRROLIDINE23DIONE
(E)(2(4methoxyphenyl)1(3(morpholin4ium4yl)propyl)45dioxopyrrolidin3ylidene)(5methyl1phenyl1Hpyrazol4yl)methanolate
(E)(2(4METHOXYPHENYL)1(3MORPHOLIN4IUM4YLPROPYL)45DIOXOPYRROLIDIN3YLIDENE)(5METHYL1PHENYLPYRAZOL4YL)METHANOLATE
3HYDROXY5(4METHOXYPHENYL)4((5METHYL1PHENYLPYRAZOL4YL)CARBONYL)1(3MORPHOLIN4YLPROPYL)3PYRROLIN2ONE
955865357
CC1=C(C=NN1C2=CC=CC=C2)C(=C3C(N(C(=O)C3=O)CCCN4CCOCC4)C5=CC=C(C=C5)OC)O
COc1ccc(cc1)C1N(CCC(NH+)2CCOCC2)C(=O)C(=O)C1=C(c1cnn(c1C)c1ccccc1)(O)
InChI=1SC29H32N4O5c12024(193033(20)227435822)27(34)2526(2191123(372)121021)32(29(36)28(25)35)1461331151738181631h35712192634H61318H212H3b2725+
MFCD18243752
ZINC000102502829
ZINC000102502838
Check stock
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