Vitas-M small molecule compound
(E)-(5-methyl-1-phenyl-1H-pyrazol-4-yl){1-[2-(morpholin-4-ium-4-yl)ethyl]-4,5-dioxo-2-[4-(propan-2-yl)phenyl]pyrrolidin-3-ylidene}methanolate
Catalog ID
STL147476
SMILES O=C1C(=O)/C(=C(\c2cnn(c2C)c2ccccc2)/[O-])/C(N1CC[NH+]1CCOCC1)c1ccc(cc1)C(C)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 C30H34N4O4 MW 514.62 g/mol Purity >90% as per NMR
InChI
InChI=1S/C30H34N4O4/c1-20(2)22-9-11-23(12-10-22)27-26(29(36)30(37)33(27)14-13-32-15-17-38-18-16-32)28(35)25-19-31-34(21(25)3)24-7-5-4-6-8-24/h4-12,19-20,27,35H,13-18H2,1-3H3/b28-26+InChIKey
GDOGUFFLRNPRIA-BYCLXTJYSA-NSynonyms
955875-77-1(4E)4(HYDROXY(5METHYL1PHENYLPYRAZOL4YL)METHYLIDENE)1(2MORPHOLIN4YLETHYL)5(4PROPAN2YLPHENYL)PYRROLIDINE23DIONE
(E)(5methyl1phenyl1Hpyrazol4yl)(1(2(morpholin4ium4yl)ethyl)45dioxo2(4(propan2yl)phenyl)pyrrolidin3ylidene)methanolate
(E)(5METHYL1PHENYLPYRAZOL4YL)(1(2MORPHOLIN4IUM4YLETHYL)45DIOXO2(4PROPAN2YLPHENYL)PYRROLIDIN3YLIDENE)METHANOLATE
3HYDROXY5(4(METHYLETHYL)PHENYL)4((5METHYL1PHENYLPYRAZOL4YL)CARBONYL)1(2MORPHOLIN4YLETHYL)3PYRROLIN2ONE
955875771
CC1=C(C=NN1C2=CC=CC=C2)C(=C3C(N(C(=O)C3=O)CCN4CCOCC4)C5=CC=C(C=C5)C(C)C)O
InChI=1SC30H34N4O4c120(2)2291123(121022)2726(29(36)30(37)33(27)141332151738181632)28(35)25193134(21(25)3)247546824h41219202735H1318H213H3b2826+
MFCD20755204
O=C1C(=O)C(=C(c2cnn(c2C)c2ccccc2)(O))C(N1CC(NH+)1CCOCC1)c1ccc(cc1)C(C)C
ZINC000102925435
ZINC000102925438
Check stock
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