Vitas-M small molecule compound

ethyl 3-({2-[4-(ethoxycarbonyl)piperazin-1-yl]propanoyl}amino)-5-methoxy-1H-indole-2-carboxylate

Catalog ID
STK538188
SMILES CCOC(=O)N1CCN(CC1)C(C(=O)Nc1c([nH]c2c1cc(OC)cc2)C(=O)OCC)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 C22H30N4O6 MW 446.50 g/mol Purity >90% as per NMR
InChI
InChI=1S/C22H30N4O6/c1-5-31-21(28)19-18(16-13-15(30-4)7-8-17(16)23-19)24-20(27)14(3)25-9-11-26(12-10-25)22(29)32-6-2/h7-8,13-14,23H,5-6,9-12H2,1-4H3,(H,24,27)
InChIKey
PIECWKFDOXELRN-UHFFFAOYSA-N
Synonyms
370843-36-0
370843360
CCOC(=O)C1=C(C2=C(N1)C=CC(=C2)OC)NC(=O)C(C)N3CCN(CC3)C(=O)OCC
CCOC(=O)N1CCN(CC1)C(C(=O)Nc1c((nH)c2c1cc(OC)cc2)C(=O)OCC)C
ethyl3((2(4(ethoxycarbonyl)piperazin1yl)propanoyl)amino)5methoxy1Hindole2carboxylate
ethyl3(2(4(ethoxycarbonyl)piperazin1yl)propanamido)5methoxy1Hindole2carboxylate
ETHYL3(2(4ETHOXYCARBONYLPIPERAZIN1YL)PROPANOYLAMINO)5METHOXY1HINDOLE2CARBOXYLATE
InChI=1SC22H30N4O6c153121(28)1918(161315(304)7817(16)2319)2420(27)14(3)2591126(121025)22(29)3262h78131423H56912H214H3(H2427)
MFCD02999105
ZINC000013810598
ZINC000013810599

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Available files

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