Vitas-M small molecule compound
(E)-[2-(3-bromophenyl)-4,5-dioxo-1-(pyrimidin-1-ium-2-yl)pyrrolidin-3-ylidene](phenyl)methanolate
Catalog ID
STL148097
SMILES Brc1cccc(c1)C1/C(=C(/c2ccccc2)\[O-])/C(=O)C(=O)N1c1nccc[nH+]1
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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 C21H14BrN3O3 MW 436.26 g/mol Purity >90% as per NMR
InChI
InChI=1S/C21H14BrN3O3/c22-15-9-4-8-14(12-15)17-16(18(26)13-6-2-1-3-7-13)19(27)20(28)25(17)21-23-10-5-11-24-21/h1-12,17,26H/b18-16+InChIKey
GEQAJIAIEGEVPI-FBMGVBCBSA-NSynonyms
369402-55-1(4E)5(3BROMOPHENYL)4(HYDROXY(PHENYL)METHYLIDENE)1PYRIMIDIN2YLPYRROLIDINE23DIONE
(E)(2(3bromophenyl)45dioxo1(pyrimidin1ium2yl)pyrrolidin3ylidene)(phenyl)methanolate
369402551
5(3BROMOPHENYL)3HYDROXY4(PHENYLCARBONYL)1PYRIMIDIN2YL3PYRROLIN2ONE
Brc1cccc(c1)C1C(=C(c2ccccc2)(O))C(=O)C(=O)N1c1nccc(nH+)1
C1=CC=C(C=C1)C(=C2C(N(C(=O)C2=O)C3=NC=CC=N3)C4=CC(=CC=C4)Br)O
InChI=1SC21H14BrN3O3c221594814(1215)1716(18(26)136213713)19(27)20(28)25(17)2123105112421h1121726Hb1816+
MFCD20755327
ZINC000101100251
ZINC000101100252
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