Vitas-M small molecule compound

ethyl 5-ethoxy-3-[({4-[3-(trifluoromethyl)phenyl]piperazin-1-yl}acetyl)amino]-1H-indole-2-carboxylate

Catalog ID
STL348141
SMILES CCOC(=O)c1[nH]c2c(c1NC(=O)CN1CCN(CC1)c1cccc(c1)C(F)(F)F)cc(cc2)OCC

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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 C26H29F3N4O4 MW 518.54 g/mol Purity >90% as per NMR
InChI
InChI=1S/C26H29F3N4O4/c1-3-36-19-8-9-21-20(15-19)23(24(30-21)25(35)37-4-2)31-22(34)16-32-10-12-33(13-11-32)18-7-5-6-17(14-18)26(27,28)29/h5-9,14-15,30H,3-4,10-13,16H2,1-2H3,(H,31,34)
InChIKey
BGDFYIBNSIWRMJ-UHFFFAOYSA-N
Synonyms
861645-22-9
861645229
CCOC(=O)c1(nH)c2c(c1NC(=O)CN1CCN(CC1)c1cccc(c1)C(F)(F)F)cc(cc2)OCC
CCOC1=CC2=C(C=C1)NC(=C2NC(=O)CN3CCN(CC3)C4=CC=CC(=C4)C(F)(F)F)C(=O)OCC
ethyl5ethoxy3(((4(3(trifluoromethyl)phenyl)piperazin1yl)acetyl)amino)1Hindole2carboxylate
ETHYL5ETHOXY3((2(4(3(TRIFLUOROMETHYL)PHENYL)PIPERAZIN1YL)ACETYL)AMINO)1HINDOLE2CARBOXYLATE
ethyl5ethoxy3(2(4(3(trifluoromethyl)phenyl)piperazin1yl)acetamido)1Hindole2carboxylate
InChI=1SC26H29F3N4O4c133619892120(1519)23(24(3021)25(35)3742)3122(34)1632101233(131132)1875617(1418)26(2728)29h59141530H34101316H212H3(H3134)
MFCD05686168
ZINC000061943452
ZINC61943452

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Available files

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