Vitas-M small molecule compound

ethyl 4-{[3-(4-chlorophenyl)-5-ethyl-1-methyl-1H-indol-2-yl]carbonyl}piperazine-1-carboxylate

Catalog ID
STK360839
SMILES CCOC(=O)N1CCN(CC1)C(=O)c1n(C)c2c(c1c1ccc(cc1)Cl)cc(cc2)CC

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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 C25H28ClN3O3 MW 453.97 g/mol Purity >90% as per NMR
InChI
InChI=1S/C25H28ClN3O3/c1-4-17-6-11-21-20(16-17)22(18-7-9-19(26)10-8-18)23(27(21)3)24(30)28-12-14-29(15-13-28)25(31)32-5-2/h6-11,16H,4-5,12-15H2,1-3H3
InChIKey
FKSLLLNGJAGWBP-UHFFFAOYSA-N
Synonyms

CCC1=CC2=C(C=C1)N(C(=C2C3=CC=C(C=C3)Cl)C(=O)N4CCN(CC4)C(=O)OCC)C
ethyl4((3(4chlorophenyl)5ethyl1methyl1Hindol2yl)carbonyl)piperazine1carboxylate
ETHYL4(3(4CHLOROPHENYL)5ETHYL1METHYL1HINDOLE2CARBONYL)PIPERAZINE1CARBOXYLATE
ethyl4(3(4chlorophenyl)5ethyl1methylindole2carbonyl)piperazine1carboxylate
InChI=1SC25H28ClN3O3c14176112120(1617)22(187919(26)10818)23(27(21)3)24(30)28121429(151328)25(31)3252h61116H451215H213H3
MFCD09992752
ZINC000019894351
ZINC19894351

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Available files

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