Vitas-M small molecule compound

4-{[4-(3-chlorophenyl)piperazin-1-yl]methyl}-6-ethyl-2H-chromen-2-one

Catalog ID
STK577090
SMILES CCc1ccc2c(c1)c(CN1CCN(CC1)c1cccc(c1)Cl)cc(=O)o2

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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 C22H23ClN2O2 MW 382.89 g/mol Purity >90% as per NMR
InChI
InChI=1S/C22H23ClN2O2/c1-2-16-6-7-21-20(12-16)17(13-22(26)27-21)15-24-8-10-25(11-9-24)19-5-3-4-18(23)14-19/h3-7,12-14H,2,8-11,15H2,1H3
InChIKey
KIIXFYAEYZTBDC-UHFFFAOYSA-N
Synonyms

4((4(3chlorophenyl)piperazin1yl)methyl)6ethyl2Hchromen2one
4((4(3chlorophenyl)piperazin1yl)methyl)6ethyl2Hchromen2onehydrochloride
4((4(3CHLOROPHENYL)PIPERAZIN1YL)METHYL)6ETHYLCHROMEN2ONE
4((4(3CHLOROPHENYL)PIPERAZINYL)METHYL)6ETHYLCHROMEN2ONE
CCC1=CC2=C(C=C1)OC(=O)C=C2CN3CCN(CC3)C4=CC(=CC=C4)Cl
CCc1ccc2c(c1)c(CN1CCN(CC1)c1cccc(c1)Cl)cc(=O)o2Cl
InChI=1SC22H23ClN2O2c1216672120(1216)17(1322(26)2721)152481025(11924)1953418(23)1419h371214H281115H21H3
MFCD05689052
ZINC000054106001
ZINC54106001

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Available files

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