Vitas-M small molecule compound

5-[4-(cyclopentyloxy)phenyl]-4-methyl-4H-1,2,4-triazole-3-thiol

Catalog ID
STK502664
SMILES Sc1nnc(n1C)c1ccc(cc1)OC1CCCC1

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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 C14H17N3OS MW 275.37 g/mol Purity >90% as per NMR
InChI
InChI=1S/C14H17N3OS/c1-17-13(15-16-14(17)19)10-6-8-12(9-7-10)18-11-4-2-3-5-11/h6-9,11H,2-5H2,1H3,(H,16,19)
InChIKey
WQSJRYKORJSYNM-UHFFFAOYSA-N
Synonyms
861433-17-2
3(4cyclopentyloxyphenyl)4methyl1H124triazole5thione
5(4(CYCLOPENTYLOXY)PHENYL)4METHYL124TRIAZOLE3THIOL
5(4(CYCLOPENTYLOXY)PHENYL)4METHYL4H124TRIAZOLE3THIOL
861433172
CN1C(=NNC1=S)C2=CC=C(C=C2)OC3CCCC3
InChI=1SC14H17N3OSc11713(151614(17)19)106812(9710)1811423511h6911H25H21H3(H1619)
MFCD04968918
ZINC000002536758
ZINC02536758
ZINC2536758

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Available files

Download the SDF, MOL, 3D structure and SDS documents from Vitas-M.