Vitas-M small molecule compound

3-(carboxy{4-[2-(ethylamino)-2-oxoethyl]piperazin-1-yl}methyl)-1-methyl-1H-indole-5-carboxylic acid

Catalog ID
STK660507
SMILES CCNC(=O)CN1CCN(CC1)C(c1cn(c2c1cc(cc2)C(=O)O)C)C(=O)O

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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/c1-3-21-17(25)12-23-6-8-24(9-7-23)18(20(28)29)15-11-22(2)16-5-4-13(19(26)27)10-14(15)16/h4-5,10-11,18H,3,6-9,12H2,1-2H3,(H,21,25)(H,26,27)(H,28,29)
InChIKey
OYNBPBGWUDMRHO-UHFFFAOYSA-N
Synonyms
1214664-07-9
1214664079
3(carboxy(4(2(ethylamino)2oxoethyl)piperazin1yl)methyl)1methyl1Hindole5carboxylicacid
3(carboxy(4(2(ethylamino)2oxoethyl)piperazin1yl)methyl)1methylindole5carboxylicacid
CCNC(=O)CN1CCN(CC1)C(C2=CN(C3=C2C=C(C=C3)C(=O)O)C)C(=O)O
InChI=1SC20H26N4O5c132117(25)12236824(9723)18(20(28)29)151122(2)165413(19(26)27)1014(15)16h45101118H36912H212H3(H2125)(H2627)(H2829)
MFCD13756498
ZINC000036354866
ZINC000036354867

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Available files

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