Vitas-M small molecule compound
2-[(6-bromo-1,3-benzodioxol-5-yl)methyl]-5-[4-(methylsulfonyl)phenyl]-2H-tetrazole
Catalog ID
STK743927
SMILES Brc1cc2OCOc2cc1Cn1nnc(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 C16H13BrN4O4S MW 437.27 g/mol Purity >90% as per NMR
InChI
InChI=1S/C16H13BrN4O4S/c1-26(22,23)12-4-2-10(3-5-12)16-18-20-21(19-16)8-11-6-14-15(7-13(11)17)25-9-24-14/h2-7H,8-9H2,1H3InChIKey
XDKXJDOERAWYFO-UHFFFAOYSA-NSynonyms
903859-39-22((6bromo13benzodioxol5yl)methyl)5(4(methylsulfonyl)phenyl)2Htetrazole
2((6bromo13benzodioxol5yl)methyl)5(4methylsulfonylphenyl)tetrazole
2((6bromobenzo(d)(13)dioxol5yl)methyl)5(4(methylsulfonyl)phenyl)2Htetrazole
903859392
CS(=O)(=O)C1=CC=C(C=C1)C2=NN(N=N2)CC3=CC4=C(C=C3Br)OCO4
InChI=1SC16H13BrN4O4Sc126(2223)124210(3512)16182021(1916)81161415(713(11)17)2592414h27H89H21H3
MFCD08286831
ZINC000013606794
ZINC13606794
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