Vitas-M small molecule compound

3-[(2-phenylethyl)sulfonyl]-4H-1,2,4-triazole

Catalog ID
STK357394
SMILES O=S(=O)(c1nnc[nH]1)CCc1ccccc1

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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 C10H11N3O2S MW 237.28 g/mol Purity >90% as per NMR
InChI
InChI=1S/C10H11N3O2S/c14-16(15,10-11-8-12-13-10)7-6-9-4-2-1-3-5-9/h1-5,8H,6-7H2,(H,11,12,13)
InChIKey
VEABVYHGTAQWNZ-UHFFFAOYSA-N
Synonyms
919971-39-4
2PHENYLETHYL4H124TRIAZOL3YLSULFONE
3((2phenylethyl)sulfonyl)4H124triazole
3(phenethylsulfonyl)4H124triazole
5(2phenylethylsulfonyl)1H124triazole
919971394
C1=CC=C(C=C1)CCS(=O)(=O)C2=NC=NN2
InChI=1SC10H11N3O2Sc1416(1510118121310)769421359h158H67H2(H111213)
MFCD09426398
O=S(=O)(c1nnc(nH)1)CCc1ccccc1
ZINC000009142800
ZINC9142800

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Available files

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