Vitas-M small molecule compound

4-(3-methoxypropyl)-5-[2-(3-methyl-1H-pyrazol-1-yl)ethyl]-4H-1,2,4-triazole-3-thiol

Catalog ID
STK306815
SMILES COCCCn1c(nnc1S)CCn1ccc(n1)C

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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 C12H19N5OS MW 281.38 g/mol Purity >90% as per NMR
InChI
InChI=1S/C12H19N5OS/c1-10-4-7-16(15-10)8-5-11-13-14-12(19)17(11)6-3-9-18-2/h4,7H,3,5-6,8-9H2,1-2H3,(H,14,19)
InChIKey
OICXARVRDAWTAA-UHFFFAOYSA-N
Synonyms
1005631-69-5
1005631695
4(3METHOXYPROPYL)3(2(3METHYLPYRAZOL1YL)ETHYL)1H124TRIAZOLE5THIONE
4(3methoxypropyl)5(2(3methyl1Hpyrazol1yl)ethyl)4H124triazole3thiol
CC1=NN(C=C1)CCC2=NNC(=S)N2CCCOC
InChI=1SC12H19N5OSc1104716(1510)8511131412(19)17(11)639182h47H35689H212H3(H1419)
MFCD04056490
ZINC000002791942
ZINC02791942
ZINC2791942

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Available files

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