Vitas-M small molecule compound

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

Catalog ID
STK227734
SMILES COc1ccccc1CNc1nc(nn1S(=O)(=O)c1ccccc1)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 C21H19N5O3S MW 421.48 g/mol Purity >90% as per NMR
InChI
InChI=1S/C21H19N5O3S/c1-29-19-12-6-5-8-16(19)15-23-21-24-20(17-9-7-13-22-14-17)25-26(21)30(27,28)18-10-3-2-4-11-18/h2-14H,15H2,1H3,(H,23,24,25)
InChIKey
WWVNFDNRTPKMEQ-UHFFFAOYSA-N
Synonyms

2(benzenesulfonyl)N((2methoxyphenyl)methyl)5pyridin3yl124triazol3amine
COC1=CC=CC=C1CNC2=NC(=NN2S(=O)(=O)C3=CC=CC=C3)C4=CN=CC=C4
InChI=1SC21H19N5O3Sc129191265816(19)1523212420(179713221417)2526(21)30(2728)18103241118h214H15H21H3(H232425)
MFCD08671804
N(2METHOXYBENZYL)1(PHENYLSULFONYL)3(PYRIDIN3YL)1H124TRIAZOL5AMINE
ZINC000009288947
ZINC09288947
ZINC9288947

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Available files

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