Vitas-M small molecule compound

2-{[(1-methyl-1H-tetrazol-5-yl)sulfanyl]methyl}benzonitrile

Catalog ID
STK136775
SMILES N#Cc1ccccc1CSc1nnnn1C

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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 C10H9N5S MW 231.28 g/mol Purity >90% as per NMR
InChI
InChI=1S/C10H9N5S/c1-15-10(12-13-14-15)16-7-9-5-3-2-4-8(9)6-11/h2-5H,7H2,1H3
InChIKey
CBGHDMHFOAUONR-UHFFFAOYSA-N
Synonyms
694504-59-1
2(((1METHYL1HTETRAZOL5YL)SULFANYL)METHYL)BENZONITRILE
2((1METHYLTETRAZOL5YL)SULFANYLMETHYL)BENZONITRILE
2(1METHYL1HTETRAZOL5YLSULFANYLMETHYL)BENZONITRILE
694504591
CN1C(=NN=N1)SCC2=CC=CC=C2C#N
InChI=1SC10H9N5Sc11510(12131415)167953248(9)611h25H7H21H3
MFCD03877660
ZINC000000617522
ZINC00617522
ZINC617522

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Available files

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