Vitas-M small molecule compound
1-{[(E)-(4-chlorophenyl)methylidene]amino}-4-(ethoxycarbonyl)-3-[2-(4-ethoxyphenyl)-2-oxoethyl]-1H-1,2,3-triazol-3-ium-5-olate
Catalog ID
STL442186
SMILES CCOC(=O)c1[n+](CC(=O)c2ccc(cc2)OCC)nn(c1[O-])/N=C/c1ccc(cc1)Cl
Contact us by email for worldwide delivery information, pricing, and real‑time availability. Send us your quotation request, and we will confirm stock levels, provide exact costs and lead times, suggest alternatives or find analogs when helpful, and share any additional specifications you may need.
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 C22H21ClN4O5 MW 456.89 g/mol Purity >90% as per NMR
InChI
InChI=1S/C22H21ClN4O5/c1-3-31-18-11-7-16(8-12-18)19(28)14-26-20(22(30)32-4-2)21(29)27(25-26)24-13-15-5-9-17(23)10-6-15/h5-13H,3-4,14H2,1-2H3/b24-13+InChIKey
UUIIGKGYZSJCSL-ZMOGYAJESA-NSynonyms
(Z)(1((E)(4chlorophenyl)methylideneamino)3(2(4ethoxyphenyl)2oxoethyl)5oxotriazol3ium4ylidene)ethoxymethanolate
1(((E)(4chlorophenyl)methylidene)amino)4(ethoxycarbonyl)3(2(4ethoxyphenyl)2oxoethyl)1H123triazol3ium5olate
CCOC(=O)c1(n+)(CC(=O)c2ccc(cc2)OCC)nn(c1(O))N=Cc1ccc(cc1)Cl
CCOC1=CC=C(C=C1)C(=O)C(N+)2=NN(C(=O)C2=C((O))OCC)N=CC3=CC=C(C=C3)Cl
InChI=1SC22H21ClN4O5c13311811716(81218)19(28)142620(22(30)3242)21(29)27(2526)2413155917(23)10615h513H3414H212H3b2413+
MFCD09992871
ZINC000033436126
Check stock
See real-time availability and sample size for STL442186 on the Vitas-M platform.
Check stock on Vitas-MAvailable files
Download the SDF, MOL, 3D structure and SDS documents from Vitas-M.