Vitas-M small molecule compound
5-[3-(4-bromo-1H-pyrazol-1-yl)phenyl]-2-[(6-chloro-1,3-benzodioxol-5-yl)methyl]-2H-tetrazole
Catalog ID
STK691920
SMILES Brc1cnn(c1)c1cccc(c1)c1nnn(n1)Cc1cc2OCOc2cc1Cl
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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 C18H12BrClN6O2 MW 459.69 g/mol Purity >90% as per NMR
InChI
InChI=1S/C18H12BrClN6O2/c19-13-7-21-25(9-13)14-3-1-2-11(4-14)18-22-24-26(23-18)8-12-5-16-17(6-15(12)20)28-10-27-16/h1-7,9H,8,10H2InChIKey
RACAKXLVAGJYSO-UHFFFAOYSA-NSynonyms
5(3(4bromo1Hpyrazol1yl)phenyl)2((6chloro13benzodioxol5yl)methyl)2Htetrazole
5(3(4bromopyrazol1yl)phenyl)2((6chloro13benzodioxol5yl)methyl)tetrazole
C1OC2=C(O1)C=C(C(=C2)CN3N=C(N=N3)C4=CC(=CC=C4)N5C=C(C=N5)Br)Cl
InChI=1SC18H12BrClN6O2c191372125(913)1431211(414)18222426(2318)81251617(615(12)20)28102716h179H810H2
MFCD10037905
ZINC000015081715
ZINC15081715
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