Vitas-M small molecule compound

1-{5-[(furan-2-ylmethyl)amino]-3-(4-methylphenyl)-1H-1,2,4-triazol-1-yl}-2-methoxyethanone

Catalog ID
STK213411
SMILES COCC(=O)n1nc(nc1NCc1ccco1)c1ccc(cc1)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 C17H18N4O3 MW 326.36 g/mol Purity >90% as per NMR
InChI
InChI=1S/C17H18N4O3/c1-12-5-7-13(8-6-12)16-19-17(18-10-14-4-3-9-24-14)21(20-16)15(22)11-23-2/h3-9H,10-11H2,1-2H3,(H,18,19,20)
InChIKey
QEVTUBXWBFNXJI-UHFFFAOYSA-N
Synonyms

1(5((FURAN2YLMETHYL)AMINO)3(4METHYLPHENYL)1H124TRIAZOL1YL)2METHOXYETHANONE
1(5(FURAN2YLMETHYLAMINO)3(4METHYLPHENYL)124TRIAZOL1YL)2METHOXYETHANONE
CC1=CC=C(C=C1)C2=NN(C(=N2)NCC3=CC=CO3)C(=O)COC
InChI=1SC17H18N4O3c1125713(8612)161917(1810144392414)21(2016)15(22)11232h39H1011H212H3(H181920)
MFCD07358674
ZINC000004385064
ZINC04385064
ZINC4385064

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Available files

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