Vitas-M small molecule compound
4-{(E)-[(1,3-dioxo-1,3,3a,4,7,7a-hexahydro-2H-spiro[2-aza-4,7-methanoisoindole-8,1'-cyclopropan]-2-yl)imino]methyl}benzonitrile
Catalog ID
STK729271
SMILES N#Cc1ccc(cc1)/C=N/N1C(=O)C2C(C1=O)C1C3(C2C=C1)CC3
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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 C19H15N3O2 MW 317.35 g/mol Purity >90% as per NMR
InChI
InChI=1S/C19H15N3O2/c20-9-11-1-3-12(4-2-11)10-21-22-17(23)15-13-5-6-14(16(15)18(22)24)19(13)7-8-19/h1-6,10,13-16H,7-8H2/b21-10+InChIKey
XPQVEXHNVYPCAX-UFFVCSGVSA-NSynonyms
4((E)((13dioxo133a477ahexahydro2Hspiro(2aza47methanoisoindole81cyclopropan)2yl)imino)methyl)benzonitrile
C1CC12C3C=CC2C4C3C(=O)N(C4=O)N=CC5=CC=C(C=C5)C#N
InChI=1SC19H15N3O2c209111312(4211)10212217(23)15135614(16(15)18(22)24)19(13)7819h16101316H78H2b2110+
MFCD01304115
N#Cc1ccc(cc1)C=NN1C(=O)C2C(C1=O)C1C3(C2C=C1)CC3
ZINC000105209710
ZINC000105209718
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