Vitas-M small molecule compound
3-(3,4-dichlorophenyl)-1-{2-[(4-ethoxyphenyl)amino]-2-oxoethyl}-1,5,6,7-tetrahydropyrrolo[1,2-a]imidazol-4-ium
Catalog ID
STL056151
SMILES CCOc1ccc(cc1)NC(=O)Cn1cc([n+]2c1CCC2)c1ccc(c(c1)Cl)Cl
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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 C22H22Cl2N3O2 MW 431.34 g/mol Purity >90% as per NMR
InChI
InChI=1S/C22H21Cl2N3O2/c1-2-29-17-8-6-16(7-9-17)25-21(28)14-26-13-20(27-11-3-4-22(26)27)15-5-10-18(23)19(24)12-15/h5-10,12-13H,2-4,11,14H2,1H3/p+1InChIKey
CIEBPVMNOGJDMB-UHFFFAOYSA-OSynonyms
2(3(34DICHLOROPHENYL)67DIHYDRO5HPYRROLO(12A)IMIDAZOL1IUM1YL)N(4ETHOXYPHENYL)ACETAMIDE
3(34dichlorophenyl)1(2((4ethoxyphenyl)amino)2oxoethyl)1567tetrahydropyrrolo(12a)imidazol4ium
CCOC1=CC=C(C=C1)NC(=O)C(N+)2=C3CCCN3C(=C2)C4=CC(=C(C=C4)Cl)Cl
CCOc1ccc(cc1)NC(=O)Cn1cc((n+)2c1CCC2)c1ccc(c(c1)Cl)Cl
InChI=1SC22H21Cl2N3O2c1229178616(7917)2521(28)14261320(27113422(26)27)1551018(23)19(24)1215h5101213H241114H21H3p+1
ZINC000013816494
ZINC13816494
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