Vitas-M small molecule compound

ethyl 3-{[2-(4-ethylpiperazin-1-yl)propanoyl]amino}-5-fluoro-1H-indole-2-carboxylate

Catalog ID
STK538478
SMILES CCOC(=O)c1[nH]c2c(c1NC(=O)C(N1CCN(CC1)CC)C)cc(cc2)F

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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 C20H27FN4O3 MW 390.46 g/mol Purity >90% as per NMR
InChI
InChI=1S/C20H27FN4O3/c1-4-24-8-10-25(11-9-24)13(3)19(26)23-17-15-12-14(21)6-7-16(15)22-18(17)20(27)28-5-2/h6-7,12-13,22H,4-5,8-11H2,1-3H3,(H,23,26)
InChIKey
KCZFSAPUTOQWOP-UHFFFAOYSA-N
Synonyms
370844-81-8
370844818
CCN1CCN(CC1)C(C)C(=O)NC2=C(NC3=C2C=C(C=C3)F)C(=O)OCC
CCOC(=O)c1(nH)c2c(c1NC(=O)C(N1CCN(CC1)CC)C)cc(cc2)F
ETHYL3(((2R)2(4ETHYLPIPERAZIN1YL)PROPANOYL)AMINO)5FLUORO1HINDOLE2CARBOXYLATE
ETHYL3(((2S)2(4ETHYLPIPERAZIN1YL)PROPANOYL)AMINO)5FLUORO1HINDOLE2CARBOXYLATE
ethyl3((2(4ethylpiperazin1yl)propanoyl)amino)5fluoro1Hindole2carboxylate
ethyl3(2(4ethylpiperazin1yl)propanamido)5fluoro1Hindole2carboxylate
ETHYL3(2(4ETHYLPIPERAZIN1YL)PROPANOYLAMINO)5FLUORO1HINDOLE2CARBOXYLATE
InChI=1SC20H27FN4O3c142481025(11924)13(3)19(26)2317151214(21)6716(15)2218(17)20(27)2852h67121322H45811H213H3(H2326)
MFCD02999342
ZINC000019372458
ZINC000019372460

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Available files

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