Vitas-M small molecule compound
4-(4-acetyl-5-methyl-1H-1,2,3-triazol-1-yl)-5-[(E)-2-phenylethenyl]benzene-1,2-dicarbonitrile
Catalog ID
STL433997
SMILES N#Cc1cc(/C=C/c2ccccc2)c(cc1C#N)n1nnc(c1C)C(=O)C
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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 C21H15N5O MW 353.38 g/mol Purity >90% as per NMR
InChI
InChI=1S/C21H15N5O/c1-14-21(15(2)27)24-25-26(14)20-11-19(13-23)18(12-22)10-17(20)9-8-16-6-4-3-5-7-16/h3-11H,1-2H3/b9-8+InChIKey
UUEAXHUVSSNXFH-CMDGGOBGSA-NSynonyms
4(4acetyl5methyl1H123triazol1yl)5((E)2phenylethenyl)benzene12dicarbonitrile
4(4acetyl5methyltriazol1yl)5((E)2phenylethenyl)benzene12dicarbonitrile
CC1=C(N=NN1C2=C(C=C(C(=C2)C#N)C#N)C=CC3=CC=CC=C3)C(=O)C
InChI=1SC21H15N5Oc11421(15(2)27)242526(14)201119(1323)18(1222)1017(20)98166435716h311H12H3b98+
MFCD26098289
N#Cc1cc(C=Cc2ccccc2)c(cc1C#N)n1nnc(c1C)C(=O)C
ZINC000078549763
ZINC78549763
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