Vitas-M small molecule compound

methyl 3-({[4-(ethoxycarbonyl)piperazin-1-yl]acetyl}amino)-5-methyl-1H-indole-2-carboxylate

Catalog ID
STK529179
SMILES CCOC(=O)N1CCN(CC1)CC(=O)Nc1c([nH]c2c1cc(C)cc2)C(=O)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 C20H26N4O5 MW 402.45 g/mol Purity >90% as per NMR
InChI
InChI=1S/C20H26N4O5/c1-4-29-20(27)24-9-7-23(8-10-24)12-16(25)22-17-14-11-13(2)5-6-15(14)21-18(17)19(26)28-3/h5-6,11,21H,4,7-10,12H2,1-3H3,(H,22,25)
InChIKey
PUFBHAUNYNWDOH-UHFFFAOYSA-N
Synonyms

CCOC(=O)N1CCN(CC1)CC(=O)Nc1c((nH)c2c1cc(C)cc2)C(=O)OC
CCOC(=O)N1CCN(CC1)CC(=O)NC2=C(NC3=C2C=C(C=C3)C)C(=O)OC
InChI=1SC20H26N4O5c142920(27)249723(81024)1216(25)2217141113(2)5615(14)2118(17)19(26)283h561121H471012H213H3(H2225)
methyl3(((4(ethoxycarbonyl)piperazin1yl)acetyl)amino)5methyl1Hindole2carboxylate
METHYL3((2(4ETHOXYCARBONYLPIPERAZIN1YL)ACETYL)AMINO)5METHYL1HINDOLE2CARBOXYLATE
methyl3(2(4(ethoxycarbonyl)piperazin1yl)acetamido)5methyl1Hindole2carboxylate
MFCD01960207
ZINC000034871196
ZINC34871196

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Available files

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