Vitas-M small molecule compound

3-(benzylsulfanyl)-4-ethyl-5-(furan-2-yl)-4H-1,2,4-triazole

Catalog ID
STL297180
SMILES CCn1c(SCc2ccccc2)nnc1c1ccco1

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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 C15H15N3OS MW 285.37 g/mol Purity >90% as per NMR
InChI
InChI=1S/C15H15N3OS/c1-2-18-14(13-9-6-10-19-13)16-17-15(18)20-11-12-7-4-3-5-8-12/h3-10H,2,11H2,1H3
InChIKey
MXWCHTWLVRGQDC-UHFFFAOYSA-N
Synonyms
618412-84-3
3(benzylsulfanyl)4ethyl5(furan2yl)4H124triazole
3(BENZYLTHIO)4ETHYL5(FURAN2YL)4H124TRIAZOLE
3BENZYLSULFANYL4ETHYL5(FURAN2YL)124TRIAZOLE
4ETHYL5(2FURYL)3(PHENYLMETHYLTHIO)124TRIAZOLE
618412843
CCN1C(=NN=C1SCC2=CC=CC=C2)C3=CC=CO3
InChI=1SC15H15N3OSc121814(1396101913)161715(18)2011127435812h310H211H21H3
MFCD04010004
ZINC000000525020
ZINC00525020
ZINC525020

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Available files

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