Vitas-M small molecule compound

ethyl 3-({3-[4-(5-chloro-2-methylphenyl)piperazin-1-yl]propanoyl}amino)-5,6-dimethoxy-1H-indole-2-carboxylate

Catalog ID
STK551693
SMILES CCOC(=O)c1[nH]c2c(c1NC(=O)CCN1CCN(CC1)c1cc(Cl)ccc1C)cc(c(c2)OC)OC

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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 C27H33ClN4O5 MW 529.04 g/mol Purity >90% as per NMR
InChI
InChI=1S/C27H33ClN4O5/c1-5-37-27(34)26-25(19-15-22(35-3)23(36-4)16-20(19)29-26)30-24(33)8-9-31-10-12-32(13-11-31)21-14-18(28)7-6-17(21)2/h6-7,14-16,29H,5,8-13H2,1-4H3,(H,30,33)
InChIKey
WZYJXGWGYOIZAM-UHFFFAOYSA-N
Synonyms
835908-92-4
835908924
CCOC(=O)c1(nH)c2c(c1NC(=O)CCN1CCN(CC1)c1cc(Cl)ccc1C)cc(c(c2)OC)OC
CCOC(=O)C1=C(C2=CC(=C(C=C2N1)OC)OC)NC(=O)CCN3CCN(CC3)C4=C(C=CC(=C4)Cl)C
ethyl3((3(4(5chloro2methylphenyl)piperazin1yl)propanoyl)amino)56dimethoxy1Hindole2carboxylate
ethyl3(3(4(5chloro2methylphenyl)piperazin1yl)propanamido)56dimethoxy1Hindole2carboxylate
ETHYL3(3(4(5CHLORO2METHYLPHENYL)PIPERAZIN1YL)PROPANOYLAMINO)56DIMETHOXY1HINDOLE2CARBOXYLATE
InChI=1SC27H33ClN4O5c153727(34)2625(191522(353)23(364)1620(19)2926)3024(33)8931101232(131131)211418(28)7617(21)2h67141629H5813H214H3(H3033)
MFCD03686962
ZINC000009461197
ZINC9461197

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Available files

Download the SDF, MOL, 3D structure and SDS documents from Vitas-M.