Vitas-M small molecule compound
1-[5-{[4-(diethylamino)benzyl]amino}-3-(pyridin-3-yl)-1H-1,2,4-triazol-1-yl]-2-methoxyethanone
Catalog ID
STK227678
SMILES COCC(=O)n1nc(nc1NCc1ccc(cc1)N(CC)CC)c1cccnc1
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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 C21H26N6O2 MW 394.48 g/mol Purity >90% as per NMR
InChI
InChI=1S/C21H26N6O2/c1-4-26(5-2)18-10-8-16(9-11-18)13-23-21-24-20(17-7-6-12-22-14-17)25-27(21)19(28)15-29-3/h6-12,14H,4-5,13,15H2,1-3H3,(H,23,24,25)InChIKey
PKNSJMFUOMWVKN-UHFFFAOYSA-NSynonyms
1(5((4(DIETHYLAMINO)BENZYL)AMINO)3(PYRIDIN3YL)1H124TRIAZOL1YL)2METHOXYETHANONE
1(5((4(DIETHYLAMINO)PHENYL)METHYLAMINO)3PYRIDIN3YL124TRIAZOL1YL)2METHOXYETHANONE
CCN(CC)C1=CC=C(C=C1)CNC2=NC(=NN2C(=O)COC)C3=CN=CC=C3
InChI=1SC21H26N6O2c1426(52)1810816(91118)1323212420(177612221417)2527(21)19(28)15293h61214H451315H213H3(H232425)
MFCD07792137
ZINC000004732555
ZINC04732555
ZINC4732555
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