Vitas-M small molecule compound
(2E)-1-[5-{[4-(diethylamino)benzyl]amino}-3-(pyridin-3-yl)-1H-1,2,4-triazol-1-yl]-3-phenylprop-2-en-1-one
Catalog ID
STK227694
SMILES CCN(c1ccc(cc1)CNc1nc(nn1C(=O)/C=C/c1ccccc1)c1cccnc1)CC
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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 C27H28N6O MW 452.56 g/mol Purity >90% as per NMR
InChI
InChI=1S/C27H28N6O/c1-3-32(4-2)24-15-12-22(13-16-24)19-29-27-30-26(23-11-8-18-28-20-23)31-33(27)25(34)17-14-21-9-6-5-7-10-21/h5-18,20H,3-4,19H2,1-2H3,(H,29,30,31)/b17-14+InChIKey
AJYXMSYQSGNDCT-SAPNQHFASA-NSynonyms
(2E)1(5((4(DIETHYLAMINO)BENZYL)AMINO)3(PYRIDIN3YL)1H124TRIAZOL1YL)3PHENYLPROP2EN1ONE
(E)1(5((4(diethylamino)phenyl)methylamino)3pyridin3yl124triazol1yl)3phenylprop2en1one
CCN(c1ccc(cc1)CNc1nc(nn1C(=O)C=Cc1ccccc1)c1cccnc1)CC
CCN(CC)C1=CC=C(C=C1)CNC2=NC(=NN2C(=O)C=CC3=CC=CC=C3)C4=CN=CC=C4
InChI=1SC27H28N6Oc1332(42)24151222(131624)1929273026(2311818282023)3133(27)25(34)17142196571021h51820H3419H212H3(H293031)b1714+
MFCD08671779
ZINC000009288917
ZINC09288917
ZINC9288917
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