Vitas-M small molecule compound
2-[(6-bromo-1,3-benzodioxol-5-yl)methyl]-5-[4-(propan-2-yl)phenyl]-2H-tetrazole
Catalog ID
STK690182
SMILES Brc1cc2OCOc2cc1Cn1nnc(n1)c1ccc(cc1)C(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 C18H17BrN4O2 MW 401.26 g/mol Purity >90% as per NMR
InChI
InChI=1S/C18H17BrN4O2/c1-11(2)12-3-5-13(6-4-12)18-20-22-23(21-18)9-14-7-16-17(8-15(14)19)25-10-24-16/h3-8,11H,9-10H2,1-2H3InChIKey
UXTDKEUHZXHQLC-UHFFFAOYSA-NSynonyms
2((6bromo13benzodioxol5yl)methyl)5(4(propan2yl)phenyl)2Htetrazole
2((6bromo13benzodioxol5yl)methyl)5(4propan2ylphenyl)tetrazole
CC(C)C1=CC=C(C=C1)C2=NN(N=N2)CC3=CC4=C(C=C3Br)OCO4
InChI=1SC18H17BrN4O2c111(2)123513(6412)18202223(2118)91471617(815(14)19)25102416h3811H910H212H3
MFCD09063297
ZINC000012401747
ZINC12401747
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