Vitas-M small molecule compound

2-amino-5-(biphenyl-4-yl)-3-[2-(3-methoxyphenyl)-2-oxoethyl]-1-methyl-1H-imidazol-3-ium

Catalog ID
STK121479
SMILES COc1cccc(c1)C(=O)C[n+]1cc(n(c1N)C)c1ccc(cc1)c1ccccc1

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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 C25H24N3O2 MW 398.48 g/mol Purity >90% as per NMR
InChI
InChI=1S/C25H23N3O2/c1-27-23(20-13-11-19(12-14-20)18-7-4-3-5-8-18)16-28(25(27)26)17-24(29)21-9-6-10-22(15-21)30-2/h3-16,26H,17H2,1-2H3/p+1
InChIKey
WDHNMWLDDZOBEC-UHFFFAOYSA-O
Synonyms

2(2AMINO3METHYL4(4PHENYLPHENYL)IMIDAZOL1IUM1YL)1(3METHOXYPHENYL)ETHANONE
2AMINO5(BIPHENYL4YL)3(2(3METHOXYPHENYL)2OXOETHYL)1METHYL1HIMIDAZOL3IUM
2AMINO5BIPHENYL4YL3(2(3METHOXYPHENYL)2OXOETHYL)1METHYL1HIMIDAZOL3IUM
CN1C(=C(N+)(=C1N)CC(=O)C2=CC(=CC=C2)OC)C3=CC=C(C=C3)C4=CC=CC=C4
COc1cccc(c1)C(=O)C(n+)1cc(n(c1N)C)c1ccc(cc1)c1ccccc1
InChI=1SC25H23N3O2c12723(20131119(121420)187435818)1628(25(27)26)1724(29)21961022(1521)302h31626H17H212H3p+1
MFCD04398859
ZINC000334157630
ZINC04698754
ZINC4698754

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Available files

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