Vitas-M small molecule compound
6-{[3-(3-bromophenyl)-1,2,4-oxadiazol-5-yl]methyl}-3-(4-ethylphenyl)-3,6-dihydro-7H-[1,2,3]triazolo[4,5-d]pyrimidin-7-one
Catalog ID
STL082355
SMILES CCc1ccc(cc1)n1nnc2c1ncn(c2=O)Cc1onc(n1)c1cccc(c1)Br
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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 C21H16BrN7O2 MW 478.31 g/mol Purity >90% as per NMR
InChI
InChI=1S/C21H16BrN7O2/c1-2-13-6-8-16(9-7-13)29-20-18(25-27-29)21(30)28(12-23-20)11-17-24-19(26-31-17)14-4-3-5-15(22)10-14/h3-10,12H,2,11H2,1H3InChIKey
BEGUVTGLVXYGJM-UHFFFAOYSA-NSynonyms
1040676-58-11040676581
6((3(3bromophenyl)124oxadiazol5yl)methyl)3(4ethylphenyl)36dihydro7H(123)triazolo(45d)pyrimidin7one
6((3(3BROMOPHENYL)124OXADIAZOL5YL)METHYL)3(4ETHYLPHENYL)3H(123)TRIAZOLO(45D)PYRIMIDIN7(6H)ONE
6((3(3bromophenyl)124oxadiazol5yl)methyl)3(4ethylphenyl)triazolo(45d)pyrimidin7one
CCC1=CC=C(C=C1)N2C3=C(C(=O)N(C=N3)CC4=NC(=NO4)C5=CC(=CC=C5)Br)N=N2
InChI=1SC21H16BrN7O2c12136816(9713)292018(252729)21(30)28(122320)11172419(263117)1443515(22)1014h31012H211H21H3
MFCD11996574
ZINC000016843405
ZINC16843405
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