Vitas-M small molecule compound
butyl 7-(5-bromo-2-methoxyphenyl)-5-methyl-4,7-dihydrotetrazolo[1,5-a]pyrimidine-6-carboxylate
Catalog ID
STL190960
SMILES CCCCOC(=O)C1=C(C)Nc2n(C1c1cc(Br)ccc1OC)nnn2
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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 C17H20BrN5O3 MW 422.28 g/mol Purity >90% as per NMR
InChI
InChI=1S/C17H20BrN5O3/c1-4-5-8-26-16(24)14-10(2)19-17-20-21-22-23(17)15(14)12-9-11(18)6-7-13(12)25-3/h6-7,9,15H,4-5,8H2,1-3H3,(H,19,20,22)InChIKey
QSPCOFAPUUSMMK-UHFFFAOYSA-NSynonyms
butyl7(5bromo2methoxyphenyl)5methyl17dihydrotetrazolo(15a)pyrimidine6carboxylate
butyl7(5bromo2methoxyphenyl)5methyl47dihydrotetrazolo(15a)pyrimidine6carboxylate
CCCCOC(=O)C1=C(N=C2N=NNN2C1C3=C(C=CC(=C3)Br)OC)C
InChI=1SC17H20BrN5O3c14582616(24)1410(2)191720212223(17)15(14)12911(18)6713(12)253h67915H458H213H3(H192022)
MFCD08805338
ZINC000040979695
ZINC000040979697
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