Vitas-M small molecule compound

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

Catalog ID
STK529921
SMILES CCN1CCN(CC1)CC(=O)Nc1c([nH]c2c1cc(Br)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 C18H23BrN4O3 MW 423.31 g/mol Purity >90% as per NMR
InChI
InChI=1S/C18H23BrN4O3/c1-3-22-6-8-23(9-7-22)11-15(24)21-16-13-10-12(19)4-5-14(13)20-17(16)18(25)26-2/h4-5,10,20H,3,6-9,11H2,1-2H3,(H,21,24)
InChIKey
KALXVXBQKKPCIR-UHFFFAOYSA-N
Synonyms

CCN1CCN(CC1)CC(=O)Nc1c((nH)c2c1cc(Br)cc2)C(=O)OC
CCN1CCN(CC1)CC(=O)NC2=C(NC3=C2C=C(C=C3)Br)C(=O)OC
InChI=1SC18H23BrN4O3c13226823(9722)1115(24)2116131012(19)4514(13)2017(16)18(25)262h451020H36911H212H3(H2124)
methyl5bromo3(((4ethylpiperazin1yl)acetyl)amino)1Hindole2carboxylate
METHYL5BROMO3((2(4ETHYLPIPERAZIN1YL)ACETYL)AMINO)1HINDOLE2CARBOXYLATE
methyl5bromo3(2(4ethylpiperazin1yl)acetamido)1Hindole2carboxylate
MFCD02240544
ZINC000019372287
ZINC19372287

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Available files

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