Vitas-M small molecule compound

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

Catalog ID
STL344063
SMILES COC(=O)c1[nH]c2c(c1NC(=O)CN1CCN(CC1)c1cccc(c1)C(F)(F)F)cc(cc2)C

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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 C24H25F3N4O3 MW 474.48 g/mol Purity >90% as per NMR
InChI
InChI=1S/C24H25F3N4O3/c1-15-6-7-19-18(12-15)21(22(28-19)23(33)34-2)29-20(32)14-30-8-10-31(11-9-30)17-5-3-4-16(13-17)24(25,26)27/h3-7,12-13,28H,8-11,14H2,1-2H3,(H,29,32)
InChIKey
RHSTUYAOTHPLEF-UHFFFAOYSA-N
Synonyms
384804-18-6
384804186
CC1=CC2=C(C=C1)NC(=C2NC(=O)CN3CCN(CC3)C4=CC=CC(=C4)C(F)(F)F)C(=O)OC
COC(=O)c1(nH)c2c(c1NC(=O)CN1CCN(CC1)c1cccc(c1)C(F)(F)F)cc(cc2)C
InChI=1SC24H25F3N4O3c115671918(1215)21(22(2819)23(33)342)2920(32)143081031(11930)1753416(1317)24(2526)27h37121328H81114H212H3(H2932)
methyl5methyl3(((4(3(trifluoromethyl)phenyl)piperazin1yl)acetyl)amino)1Hindole2carboxylate
METHYL5METHYL3((2(4(3(TRIFLUOROMETHYL)PHENYL)PIPERAZIN1YL)ACETYL)AMINO)1HINDOLE2CARBOXYLATE
methyl5methyl3(2(4(3(trifluoromethyl)phenyl)piperazin1yl)acetamido)1Hindole2carboxylate
MFCD01857254
ZINC000061931418
ZINC61931418

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Available files

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