Vitas-M small molecule compound

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

Catalog ID
STK211660
SMILES COc1ccc(cc1)CNc1nc(nn1S(=O)(=O)C)c1ccc(cc1)OC

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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 C18H20N4O4S MW 388.45 g/mol Purity >90% as per NMR
InChI
InChI=1S/C18H20N4O4S/c1-25-15-8-4-13(5-9-15)12-19-18-20-17(21-22(18)27(3,23)24)14-6-10-16(26-2)11-7-14/h4-11H,12H2,1-3H3,(H,19,20,21)
InChIKey
HABGVSRQKUODET-UHFFFAOYSA-N
Synonyms

5(4METHOXYPHENYL)N((4METHOXYPHENYL)METHYL)2METHYLSULFONYL124TRIAZOL3AMINE
COC1=CC=C(C=C1)CNC2=NC(=NN2S(=O)(=O)C)C3=CC=C(C=C3)OC
InChI=1SC18H20N4O4Sc125158413(5915)1219182017(2122(18)27(323)24)1461016(262)11714h411H12H213H3(H192021)
MFCD08671628
N(4METHOXYBENZYL)3(4METHOXYPHENYL)1(METHYLSULFONYL)1H124TRIAZOL5AMINE
ZINC000004777307
ZINC04777307
ZINC4777307

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Available files

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