Vitas-M small molecule compound

methyl 4-{5-[(2-methoxy-2-oxoethyl)sulfanyl]-1H-tetrazol-1-yl}benzoate

Catalog ID
STL234107
SMILES COC(=O)CSc1nnnn1c1ccc(cc1)C(=O)OC

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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 C12H12N4O4S MW 308.32 g/mol Purity >90% as per NMR
InChI
InChI=1S/C12H12N4O4S/c1-19-10(17)7-21-12-13-14-15-16(12)9-5-3-8(4-6-9)11(18)20-2/h3-6H,7H2,1-2H3
InChIKey
FPMZKSVQDXCIAY-UHFFFAOYSA-N
Synonyms
346464-89-9
346464899
4(5METHOXYCARBONYLMETHYLSULFANYLTETRAZOL1YL)BENZOICACIDMETHYLESTER
COC(=O)CSC1=NN=NN1C2=CC=C(C=C2)C(=O)OC
InChI=1SC12H12N4O4Sc11910(17)7211213141516(12)9538(469)11(18)202h36H7H212H3
methyl4(5((2methoxy2oxoethyl)sulfanyl)1Htetrazol1yl)benzoate
methyl4(5((2methoxy2oxoethyl)thio)1Htetrazol1yl)benzoate
METHYL4(5(2METHOXY2OXOETHYL)SULFANYLTETRAZOL1YL)BENZOATE
MFCD01580926
ZINC000000306797
ZINC00306797
ZINC306797

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Available files

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