Vitas-M small molecule compound
1-[2-(4-tert-butylphenyl)-2-oxoethyl]-3-(4-methylphenyl)-1,5,6,7-tetrahydropyrrolo[1,2-a]imidazol-4-ium
Catalog ID
STL050570
SMILES Cc1ccc(cc1)c1cn(c2[n+]1CCC2)CC(=O)c1ccc(cc1)C(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 C25H29N2O MW 373.52 g/mol Purity >90% as per NMR
InChI
InChI=1S/C25H29N2O/c1-18-7-9-19(10-8-18)22-16-26(24-6-5-15-27(22)24)17-23(28)20-11-13-21(14-12-20)25(2,3)4/h7-14,16H,5-6,15,17H2,1-4H3/q+1InChIKey
BNXKPXNENPEFSB-UHFFFAOYSA-NSynonyms
1(2(4tertbutylphenyl)2oxoethyl)3(4methylphenyl)1567tetrahydropyrrolo(12a)imidazol4ium
1(4TERTBUTYLPHENYL)2(3(4METHYLPHENYL)67DIHYDRO5HPYRROLO(12A)IMIDAZOL1IUM1YL)ETHANONE
CC1=CC=C(C=C1)C2=C(N+)(=C3N2CCC3)CC(=O)C4=CC=C(C=C4)C(C)(C)C
Cc1ccc(cc1)c1cn(c2(n+)1CCC2)CC(=O)c1ccc(cc1)C(C)(C)C
InChI=1SC25H29N2Oc1187919(10818)221626(24651527(22)24)1723(28)20111321(141220)25(23)4h71416H561517H214H3q+1
ZINC000013776094
ZINC13776094
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