Vitas-M small molecule compound

methyl N-{[(1-phenyl-1H-tetrazol-5-yl)sulfanyl]acetyl}leucinate

Catalog ID
STK270329
SMILES COC(=O)C(NC(=O)CSc1nnnn1c1ccccc1)CC(C)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 C16H21N5O3S MW 363.44 g/mol Purity >90% as per NMR
InChI
InChI=1S/C16H21N5O3S/c1-11(2)9-13(15(23)24-3)17-14(22)10-25-16-18-19-20-21(16)12-7-5-4-6-8-12/h4-8,11,13H,9-10H2,1-3H3,(H,17,22)
InChIKey
QXANKOCASLNBGK-UHFFFAOYSA-N
Synonyms

CC(C)CC(C(=O)OC)NC(=O)CSC1=NN=NN1C2=CC=CC=C2
InChI=1SC16H21N5O3Sc111(2)913(15(23)243)1714(22)10251618192021(16)127546812h481113H910H213H3(H1722)
methyl4methyl2((2(1phenyltetrazol5yl)sulfanylacetyl)amino)pentanoate
methylN(((1phenyl1Htetrazol5yl)sulfanyl)acetyl)leucinate
MFCD02818213
ZINC000007339970
ZINC000007339971

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Available files

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