Vitas-M small molecule compound

3-[(4-ethoxybenzyl)sulfanyl]-5-methyl-4H-1,2,4-triazol-4-amine

Catalog ID
STK805405
SMILES CCOc1ccc(cc1)CSc1nnc(n1N)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 C12H16N4OS MW 264.35 g/mol Purity >90% as per NMR
InChI
InChI=1S/C12H16N4OS/c1-3-17-11-6-4-10(5-7-11)8-18-12-15-14-9(2)16(12)13/h4-7H,3,8,13H2,1-2H3
InChIKey
CXAMKVUJWIFZLQ-UHFFFAOYSA-N
Synonyms
57736-76-2
3((4ethoxybenzyl)sulfanyl)5methyl4H124triazol4amine
3((4ethoxybenzyl)thio)5methyl4H124triazol4amine
3((4ETHOXYPHENYL)METHYLSULFANYL)5METHYL124TRIAZOL4AMINE
3(4ETHOXYBENZYLSULFANYL)5METHYL(124)TRIAZOL4YLAMINE
57736762
CCOC1=CC=C(C=C1)CSC2=NN=C(N2N)C
InChI=1SC12H16N4OSc1317116410(5711)8181215149(2)16(12)13h47H3813H212H3
MFCD00440554
ZINC000000305872
ZINC00305872
ZINC305872

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Available files

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