Vitas-M small molecule compound
3-(3-methylbenzyl)-6-({3-[3-(trifluoromethyl)phenyl]-1,2,4-oxadiazol-5-yl}methyl)-3,6-dihydro-7H-[1,2,3]triazolo[4,5-d]pyrimidin-7-one
Catalog ID
STL082349
SMILES Cc1cccc(c1)Cn1nnc2c1ncn(c2=O)Cc1onc(n1)c1cccc(c1)C(F)(F)F
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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 C22H16F3N7O2 MW 467.41 g/mol Purity >90% as per NMR
InChI
InChI=1S/C22H16F3N7O2/c1-13-4-2-5-14(8-13)10-32-20-18(28-30-32)21(33)31(12-26-20)11-17-27-19(29-34-17)15-6-3-7-16(9-15)22(23,24)25/h2-9,12H,10-11H2,1H3InChIKey
OPLCNJFASURJLX-UHFFFAOYSA-NSynonyms
1040640-19-41040640194
3((3methylphenyl)methyl)6((3(3(trifluoromethyl)phenyl)124oxadiazol5yl)methyl)triazolo(45d)pyrimidin7one
3(3methylbenzyl)6((3(3(trifluoromethyl)phenyl)124oxadiazol5yl)methyl)36dihydro7H(123)triazolo(45d)pyrimidin7one
3(3METHYLBENZYL)6((3(3(TRIFLUOROMETHYL)PHENYL)124OXADIAZOL5YL)METHYL)3H(123)TRIAZOLO(45D)PYRIMIDIN7(6H)ONE
CC1=CC(=CC=C1)CN2C3=C(C(=O)N(C=N3)CC4=NC(=NO4)C5=CC(=CC=C5)C(F)(F)F)N=N2
InChI=1SC22H16F3N7O2c11342514(813)10322018(283032)21(33)31(122620)11172719(293417)1563716(915)22(2324)25h2912H1011H21H3
MFCD11997245
ZINC000016845501
ZINC16845501
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