Vitas-M small molecule compound

4-(4-chlorobenzyl)-5-(methoxymethyl)-4H-1,2,4-triazole-3-thiol

Catalog ID
STK445231
SMILES COCc1nnc(n1Cc1ccc(cc1)Cl)S

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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 C11H12ClN3OS MW 269.75 g/mol Purity >90% as per NMR
InChI
InChI=1S/C11H12ClN3OS/c1-16-7-10-13-14-11(17)15(10)6-8-2-4-9(12)5-3-8/h2-5H,6-7H2,1H3,(H,14,17)
InChIKey
BGIIDDXEUQOLMP-UHFFFAOYSA-N
Synonyms

4((4chlorophenyl)methyl)3(methoxymethyl)1H124triazole5thione
4((4CHLOROPHENYL)METHYL)5(METHOXYMETHYL)124TRIAZOLE3THIOL
4(4chlorobenzyl)5(methoxymethyl)4H124triazole3thiol
COCC1=NNC(=S)N1CC2=CC=C(C=C2)Cl
InChI=1SC11H12ClN3OSc116710131411(17)15(10)68249(12)538h25H67H21H3(H1417)
MFCD04057885
ZINC000006490512
ZINC06490512
ZINC6490512

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Available files

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