Vitas-M small molecule compound
4-{(E)-1-cyano-2-[5-(4-methoxy-2-nitrophenyl)furan-2-yl]ethenyl}benzonitrile
Catalog ID
STK293132
SMILES COc1ccc(c(c1)[N+](=O)[O-])c1ccc(o1)/C=C(\c1ccc(cc1)C#N)/C#N
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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 C21H13N3O4 MW 371.35 g/mol Purity >90% as per NMR
InChI
InChI=1S/C21H13N3O4/c1-27-17-6-8-19(20(11-17)24(25)26)21-9-7-18(28-21)10-16(13-23)15-4-2-14(12-22)3-5-15/h2-11H,1H3/b16-10-InChIKey
KFUBWQOXCSWGEV-YBEGLDIGSA-NSynonyms
4((E)1CYANO2(5(4METHOXY2NITROPHENYL)FURAN2YL)ETHENYL)BENZONITRILE
COC1=CC(=C(C=C1)C2=CC=C(O2)C=C(C#N)C3=CC=C(C=C3)C#N)(N+)(=O)(O)
COc1ccc(c(c1)(N+)(=O)(O))c1ccc(o1)C=C(c1ccc(cc1)C#N)C#N
InChI=1SC21H13N3O4c127176819(20(1117)24(25)26)219718(2821)1016(1323)154214(1222)3515h211H1H3b1610
MFCD05801890
ZINC000016215676
ZINC16215676
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