Vitas-M small molecule compound
5-heptyl-4-(prop-2-en-1-yl)-4H-1,2,4-triazole-3-thiol
Catalog ID
STK601556
SMILES CCCCCCCc1nnc(n1CC=C)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 C12H21N3S MW 239.38 g/mol Purity >90% as per NMR
InChI
InChI=1S/C12H21N3S/c1-3-5-6-7-8-9-11-13-14-12(16)15(11)10-4-2/h4H,2-3,5-10H2,1H3,(H,14,16)InChIKey
IISYDPDYJXBUCV-UHFFFAOYSA-NSynonyms
797767-73-83HEPTYL4PROP2ENYL1H124TRIAZOLE5THIONE
4ALLYL5HEPTYL4H124TRIAZOLE3THIOL
5heptyl4(prop2en1yl)4H124triazole3thiol
797767738
CCCCCCCC1=NNC(=S)N1CC=C
InChI=1SC12H21N3Sc135678911131412(16)15(11)1042h4H23510H21H3(H1416)
MFCD03665221
ZINC000002371338
ZINC2371338
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