Vitas-M small molecule compound
3-(4-chlorophenyl)-1-(2-oxo-2-{[(2E)-4-phenyl-1,3-thiazol-2(3H)-ylidene]amino}ethyl)-1,5,6,7-tetrahydropyrrolo[1,2-a]imidazol-4-ium
Catalog ID
STL057885
SMILES Clc1ccc(cc1)c1cn(c2[n+]1CCC2)CC(=O)/N=c\1/scc([nH]1)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 C23H20ClN4OS MW 435.96 g/mol Purity >90% as per NMR
InChI
InChI=1S/C23H19ClN4OS/c24-18-10-8-17(9-11-18)20-13-27(22-7-4-12-28(20)22)14-21(29)26-23-25-19(15-30-23)16-5-2-1-3-6-16/h1-3,5-6,8-11,13,15H,4,7,12,14H2/p+1InChIKey
YKZAOYMNDJELDO-UHFFFAOYSA-OSynonyms
2(3(4CHLOROPHENYL)67DIHYDRO5HPYRROLO(12A)IMIDAZOL1IUM1YL)N(4PHENYL13THIAZOL2YL)ACETAMIDE
3(4chlorophenyl)1(2oxo2(((2E)4phenyl13thiazol2(3H)ylidene)amino)ethyl)1567tetrahydropyrrolo(12a)imidazol4ium
C1CC2=(N+)(C=C(N2C1)C3=CC=C(C=C3)Cl)CC(=O)NC4=NC(=CS4)C5=CC=CC=C5
Clc1ccc(cc1)c1cn(c2(n+)1CCC2)CC(=O)N=c1scc((nH)1)c1ccccc1
InChI=1SC23H19ClN4OSc241810817(91118)201327(22741228(20)22)1421(29)26232519(153023)165213616h13568111315H471214H2p+1
ZINC000002403301
ZINC02403301
ZINC2403301
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