Vitas-M small molecule compound

N-(4-methoxybenzyl)-1-(phenylsulfonyl)-3-(thiophen-2-yl)-1H-1,2,4-triazol-5-amine

Catalog ID
STK246532
SMILES COc1ccc(cc1)CNc1nc(nn1S(=O)(=O)c1ccccc1)c1cccs1

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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 C20H18N4O3S2 MW 426.52 g/mol Purity >90% as per NMR
InChI
InChI=1S/C20H18N4O3S2/c1-27-16-11-9-15(10-12-16)14-21-20-22-19(18-8-5-13-28-18)23-24(20)29(25,26)17-6-3-2-4-7-17/h2-13H,14H2,1H3,(H,21,22,23)
InChIKey
RGNMOJHNMWYICC-UHFFFAOYSA-N
Synonyms

2(benzenesulfonyl)N((4methoxyphenyl)methyl)5thiophen2yl124triazol3amine
COC1=CC=C(C=C1)CNC2=NC(=NN2S(=O)(=O)C3=CC=CC=C3)C4=CC=CS4
InChI=1SC20H18N4O3S2c1271611915(101216)1421202219(1885132818)2324(20)29(2526)176324717h213H14H21H3(H212223)
MFCD08685148
N(4methoxybenzyl)1(phenylsulfonyl)3(thiophen2yl)1H124triazol5amine
ZINC000009667649
ZINC09667649
ZINC9667649

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Available files

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