Vitas-M small molecule compound

N-(furan-2-ylmethyl)-3-(4-methoxyphenyl)-1-(methylsulfonyl)-1H-1,2,4-triazol-5-amine

Catalog ID
STK211643
SMILES COc1ccc(cc1)c1nc(n(n1)S(=O)(=O)C)NCc1ccco1

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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 C15H16N4O4S MW 348.38 g/mol Purity >90% as per NMR
InChI
InChI=1S/C15H16N4O4S/c1-22-12-7-5-11(6-8-12)14-17-15(19(18-14)24(2,20)21)16-10-13-4-3-9-23-13/h3-9H,10H2,1-2H3,(H,16,17,18)
InChIKey
BEHBXYROZZYBCU-UHFFFAOYSA-N
Synonyms

COC1=CC=C(C=C1)C2=NN(C(=N2)NCC3=CC=CO3)S(=O)(=O)C
InChI=1SC15H16N4O4Sc122127511(6812)141715(19(1814)24(220)21)1610134392313h39H10H212H3(H161718)
MFCD08671612
N(FURAN2YLMETHYL)3(4METHOXYPHENYL)1(METHYLSULFONYL)1H124TRIAZOL5AMINE
N(FURAN2YLMETHYL)5(4METHOXYPHENYL)2METHYLSULFONYL124TRIAZOL3AMINE
ZINC000004777292
ZINC04777292
ZINC4777292

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Available files

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