Vitas-M small molecule compound

1-{5-[(2-methoxybenzyl)amino]-3-(pyridin-3-yl)-1H-1,2,4-triazol-1-yl}-2-methylpropan-1-one

Catalog ID
STK227701
SMILES COc1ccccc1CNc1nc(nn1C(=O)C(C)C)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 C19H21N5O2 MW 351.41 g/mol Purity >90% as per NMR
InChI
InChI=1S/C19H21N5O2/c1-13(2)18(25)24-19(21-12-14-7-4-5-9-16(14)26-3)22-17(23-24)15-8-6-10-20-11-15/h4-11,13H,12H2,1-3H3,(H,21,22,23)
InChIKey
UFMQGTLNFGCPFV-UHFFFAOYSA-N
Synonyms

1(5((2METHOXYBENZYL)AMINO)3(PYRIDIN3YL)1H124TRIAZOL1YL)2METHYLPROPAN1ONE
1(5((2METHOXYPHENYL)METHYLAMINO)3PYRIDIN3YL124TRIAZOL1YL)2METHYLPROPAN1ONE
CC(C)C(=O)N1C(=NC(=N1)C2=CN=CC=C2)NCC3=CC=CC=C3OC
InChI=1SC19H21N5O2c113(2)18(25)2419(211214745916(14)263)2217(2324)158610201115h41113H12H213H3(H212223)
MFCD07792140
ZINC000004732570
ZINC04732570
ZINC4732570

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Available files

Download the SDF, MOL, 3D structure and SDS documents from Vitas-M.