Vitas-M small molecule compound

2-(4-chlorobenzyl)-8-ethoxy-1,3-dimethylcyclohepta[c]pyrrol-4(2H)-one

Catalog ID
STK086194
SMILES CCOc1cccc(=O)c2c1c(C)n(c2C)Cc1ccc(cc1)Cl

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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 C20H20ClNO2 MW 341.84 g/mol Purity >90% as per NMR
InChI
InChI=1S/C20H20ClNO2/c1-4-24-18-7-5-6-17(23)19-13(2)22(14(3)20(18)19)12-15-8-10-16(21)11-9-15/h5-11H,4,12H2,1-3H3
InChIKey
PTQJXFLYSQXYEP-UHFFFAOYSA-N
Synonyms
433945-73-4
2((4CHLOROPHENYL)METHYL)4ETHOXY13DIMETHYLCYCLOHEPTA(C)PYRROL8ONE
2(4CHLOROBENZYL)8ETHOXY13DIMETHYL2HCYCLOHEPTA(C)PYRROL4ONE
2(4CHLOROBENZYL)8ETHOXY13DIMETHYLCYCLOHEPTA(C)PYRROL4(2H)ONE
433945734
CCOC1=CC=CC(=O)C2=C(N(C(=C12)C)CC3=CC=C(C=C3)Cl)C
CCOc1cccc(=O)c2c1c(C)n(c2C)Cc1ccc(cc1)Cl
InChI=1SC20H20ClNO2c14241875617(23)1913(2)22(14(3)20(18)19)121581016(21)11915h511H412H213H3
MFCD03408736
STK086194
ZINC000000054455
ZINC00054455
ZINC54455

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Available files

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