Vitas-M small molecule compound

4-methyl-5-(4-propoxybenzyl)-2,4-dihydro-3H-1,2,4-triazole-3-thione

Catalog ID
STL038223
SMILES CCCOc1ccc(cc1)Cc1n[nH]c(=S)n1C

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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 C13H17N3OS MW 263.36 g/mol Purity >90% as per NMR
InChI
InChI=1S/C13H17N3OS/c1-3-8-17-11-6-4-10(5-7-11)9-12-14-15-13(18)16(12)2/h4-7H,3,8-9H2,1-2H3,(H,15,18)
InChIKey
IJXCPRDMIKUCEI-UHFFFAOYSA-N
Synonyms
69198-28-3
4METHYL3((4PROPOXYPHENYL)METHYL)1H124TRIAZOLE5THIONE
4methyl5(4propoxybenzyl)24dihydro3H124triazole3thione
69198283
CCCOC1=CC=C(C=C1)CC2=NNC(=S)N2C
CCCOc1ccc(cc1)Cc1n(nH)c(=S)n1C
InChI=1SC13H17N3OSc13817116410(5711)912141513(18)16(12)2h47H389H212H3(H1518)
MFCD03816604
ZINC000002374563
ZINC02374563
ZINC2374563

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Available files

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