Vitas-M small molecule compound
4-(4-chlorobenzyl)-5-propyl-4H-1,2,4-triazole-3-thiol
Catalog ID
STK444289
SMILES CCCc1nnc(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 C12H14ClN3S MW 267.78 g/mol Purity >90% as per NMR
InChI
InChI=1S/C12H14ClN3S/c1-2-3-11-14-15-12(17)16(11)8-9-4-6-10(13)7-5-9/h4-7H,2-3,8H2,1H3,(H,15,17)InChIKey
PVPHHJAJPOKAHK-UHFFFAOYSA-NSynonyms
4((4chlorophenyl)methyl)3propyl1H124triazole5thione
4((4CHLOROPHENYL)METHYL)5PROPYL124TRIAZOLE3THIOL
4(4chlorobenzyl)5propyl4H124triazole3thiol
CCCC1=NNC(=S)N1CC2=CC=C(C=C2)Cl
InChI=1SC12H14ClN3Sc12311141512(17)16(11)894610(13)759h47H238H21H3(H1517)
MFCD04055471
ZINC000006400098
ZINC06400098
ZINC6400098
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