Vitas-M small molecule compound

ethyl {5-[4-(methylsulfonyl)phenyl]-2H-tetrazol-2-yl}acetate

Catalog ID
STK743558
SMILES CCOC(=O)Cn1nnc(n1)c1ccc(cc1)S(=O)(=O)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 C12H14N4O4S MW 310.33 g/mol Purity >90% as per NMR
InChI
InChI=1S/C12H14N4O4S/c1-3-20-11(17)8-16-14-12(13-15-16)9-4-6-10(7-5-9)21(2,18)19/h4-7H,3,8H2,1-2H3
InChIKey
KGJJXJHOKPQOQK-UHFFFAOYSA-N
Synonyms

(5(4METHANESULFONYLPHENYL)TETRAZOL2YL)ACETICACIDETHYLESTER
CCOC(=O)CN1N=C(N=N1)C2=CC=C(C=C2)S(=O)(=O)C
ethyl(5(4(methylsulfonyl)phenyl)2Htetrazol2yl)acetate
ETHYL2(5(4METHYLSULFONYLPHENYL)TETRAZOL2YL)ACETATE
InChI=1SC12H14N4O4Sc132011(17)8161412(131516)94610(759)21(218)19h47H38H212H3
MFCD03855569
ZINC000000111590
ZINC00111590
ZINC111590

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Available files

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