Vitas-M small molecule compound

ethyl 4-{N-[(6-chloro-1,3,4,9-tetrahydro-2H-beta-carbolin-2-yl)carbonyl]glycyl}piperazine-1-carboxylate

Catalog ID
STK631941
SMILES CCOC(=O)N1CCN(CC1)C(=O)CNC(=O)N1CCc2c(C1)[nH]c1c2cc(cc1)Cl

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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 C21H26ClN5O4 MW 447.92 g/mol Purity >90% as per NMR
InChI
InChI=1S/C21H26ClN5O4/c1-2-31-21(30)26-9-7-25(8-10-26)19(28)12-23-20(29)27-6-5-15-16-11-14(22)3-4-17(16)24-18(15)13-27/h3-4,11,24H,2,5-10,12-13H2,1H3,(H,23,29)
InChIKey
OPOMZBWQFUUZFX-UHFFFAOYSA-N
Synonyms
1010914-53-0
1010914530
CCOC(=O)N1CCN(CC1)C(=O)CNC(=O)N1CCc2c(C1)(nH)c1c2cc(cc1)Cl
CCOC(=O)N1CCN(CC1)C(=O)CNC(=O)N2CCC3=C(C2)NC4=C3C=C(C=C4)Cl
ethyl4(2((6chloro1349tetrahydropyrido(34b)indole2carbonyl)amino)acetyl)piperazine1carboxylate
ethyl4(2(6chloro2349tetrahydro1Hpyrido(34b)indole2carboxamido)acetyl)piperazine1carboxylate
ethyl4(N((6chloro1349tetrahydro2Hbetacarbolin2yl)carbonyl)glycyl)piperazine1carboxylate
InChI=1SC21H26ClN5O4c123121(30)269725(81026)19(28)122320(29)276515161114(22)3417(16)2418(15)1327h341124H25101213H21H3(H2329)
MFCD12199110
ZINC000012321229
ZINC12321229

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Available files

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