Vitas-M small molecule compound
butyl 7-(5-bromo-2-methoxyphenyl)-5-methyl-4,7-dihydro[1,2,4]triazolo[1,5-a]pyrimidine-6-carboxylate
Catalog ID
STK914825
SMILES CCCCOC(=O)C1=C(C)Nc2n(C1c1cc(Br)ccc1OC)ncn2
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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 C18H21BrN4O3 MW 421.29 g/mol Purity >90% as per NMR
InChI
InChI=1S/C18H21BrN4O3/c1-4-5-8-26-17(24)15-11(2)22-18-20-10-21-23(18)16(15)13-9-12(19)6-7-14(13)25-3/h6-7,9-10,16H,4-5,8H2,1-3H3,(H,20,21,22)InChIKey
CTZSPGHJGGGJDY-UHFFFAOYSA-NSynonyms
BUTYL7(5BROMO2METHOXYPHENYL)5METHYL17DIHYDRO(124)TRIAZOLO(15A)PYRIMIDINE6CARBOXYLATE
butyl7(5bromo2methoxyphenyl)5methyl47dihydro(124)triazolo(15a)pyrimidine6carboxylate
CCCCOC(=O)C1=C(N=C2N=CNN2C1C3=C(C=CC(=C3)Br)OC)C
InChI=1SC18H21BrN4O3c14582617(24)1511(2)221820102123(18)16(15)13912(19)6714(13)253h6791016H458H213H3(H202122)
MFCD05031840
ZINC000009942176
ZINC000009942179
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