Vitas-M small molecule compound

3-[(2,6-dichlorobenzyl)sulfanyl]-5-(4-ethoxyphenyl)-4H-1,2,4-triazol-4-amine

Catalog ID
STL339162
SMILES CCOc1ccc(cc1)c1nnc(n1N)SCc1c(Cl)cccc1Cl

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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 C17H16Cl2N4OS MW 395.31 g/mol Purity >90% as per NMR
InChI
InChI=1S/C17H16Cl2N4OS/c1-2-24-12-8-6-11(7-9-12)16-21-22-17(23(16)20)25-10-13-14(18)4-3-5-15(13)19/h3-9H,2,10,20H2,1H3
InChIKey
HUENEOOLIFSULT-UHFFFAOYSA-N
Synonyms
681004-84-2
3((26dichlorobenzyl)sulfanyl)5(4ethoxyphenyl)4H124triazol4amine
3((26dichlorobenzyl)thio)5(4ethoxyphenyl)4H124triazol4amine
3((26DICHLOROPHENYL)METHYLSULFANYL)5(4ETHOXYPHENYL)124TRIAZOL4AMINE
681004842
CCOC1=CC=C(C=C1)C2=NN=C(N2N)SCC3=C(C=CC=C3Cl)Cl
InChI=1SC17H16Cl2N4OSc1224128611(7912)16212217(23(16)20)25101314(18)43515(13)19h39H21020H21H3
MFCD04009197
ZINC000005100986
ZINC05100986
ZINC5100986

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Available files

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