Vitas-M small molecule compound
4-{(E)-[(1,3-dioxo-1,3,3a,4,7,7a-hexahydro-2H-4,7-ethanoisoindol-2-yl)imino]methyl}benzonitrile
Catalog ID
STL417467
SMILES N#Cc1ccc(cc1)/C=N/N1C(=O)C2C(C1=O)C1CCC2C=C1
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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 C18H15N3O2 MW 305.34 g/mol Purity >90% as per NMR
InChI
InChI=1S/C18H15N3O2/c19-9-11-1-3-12(4-2-11)10-20-21-17(22)15-13-5-6-14(8-7-13)16(15)18(21)23/h1-6,10,13-16H,7-8H2/b20-10+InChIKey
YMSGKYCWHSEKNH-KEBDBYFISA-NSynonyms
4((E)((13dioxo133a477ahexahydro2H47ethanoisoindol2yl)imino)methyl)benzonitrile
C1CC2C=CC1C3C2C(=O)N(C3=O)N=CC4=CC=C(C=C4)C#N
InChI=1SC18H15N3O2c199111312(4211)10202117(22)15135614(8713)16(15)18(21)23h16101316H78H2b2010+
MFCD00826706
N#Cc1ccc(cc1)C=NN1C(=O)C2C(C1=O)C1CCC2C=C1
ZINC000100175735
ZINC000225108956
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