Vitas-M small molecule compound

17-(2-chlorophenyl)-1-methyl-17-azapentacyclo[6.6.5.0~2,7~.0~9,14~.0~15,19~]nonadeca-2,4,6,9,11,13-hexaene-16,18-dione (non-preferred name)

Catalog ID
STK720156
SMILES Clc1ccccc1N1C(=O)C2C(C1=O)C1(C)c3c(C2c2c1cccc2)cccc3

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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 C25H18ClNO2 MW 399.88 g/mol Purity >90% as per NMR
InChI
InChI=1S/C25H18ClNO2/c1-25-16-10-4-2-8-14(16)20(15-9-3-5-11-17(15)25)21-22(25)24(29)27(23(21)28)19-13-7-6-12-18(19)26/h2-13,20-22H,1H3
InChIKey
DJSAESLZQSCBQB-UHFFFAOYSA-N
Synonyms

17(2chlorophenyl)1methyl17azapentacyclo(6650~27~0~914~0~1519~)nonadeca24691113hexaene1618dione(nonpreferredname)
CC12C3C(C(C4=CC=CC=C41)C5=CC=CC=C25)C(=O)N(C3=O)C6=CC=CC=C6Cl
InChI=1SC25H18ClNO2c125161042814(16)20(159351117(15)25)2122(25)24(29)27(23(21)28)1913761218(19)26h2132022H1H3
MFCD00577850
ZINC000001058016
ZINC000001058021

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Available files

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