Vitas-M small molecule compound
17-benzyl-16,18-dioxo-17-azapentacyclo[6.6.5.0~2,7~.0~9,14~.0~15,19~]nonadeca-2,4,6,9,11,13-hexaene-1-carbonitrile (non-preferred name)
Catalog ID
STK082909
SMILES N#CC12C3C(=O)N(C(=O)C3C(c3c1cccc3)c1c2cccc1)Cc1ccccc1
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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 C26H18N2O2 MW 390.44 g/mol Purity >90% as per NMR
InChI
InChI=1S/C26H18N2O2/c27-15-26-19-12-6-4-10-17(19)21(18-11-5-7-13-20(18)26)22-23(26)25(30)28(24(22)29)14-16-8-2-1-3-9-16/h1-13,21-23H,14H2InChIKey
RAKWDQWMBUADHW-UHFFFAOYSA-NSynonyms
17benzyl1618dioxo17azapentacyclo(6650~27~0~914~0~1519~)nonadeca24691113hexaene1carbonitrile(nonpreferredname)
C1=CC=C(C=C1)CN2C(=O)C3C4C5=CC=CC=C5C(C3C2=O)(C6=CC=CC=C46)C#N
InChI=1SC26H18N2O2c2715261912641017(19)21(1811571320(18)26)2223(26)25(30)28(24(22)29)14168213916h1132123H14H2
MFCD01070482
N#CC12C3C(=O)N(C(=O)C3C(c3c1cccc3)c1c2cccc1)Cc1ccccc1
STK082909
ZINC000001093930
ZINC000001093933
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