Vitas-M small molecule compound
methyl 4-[({8-[3-(4-methylphenyl)-1,2,4-oxadiazol-5-yl]-3-oxo[1,2,4]triazolo[4,3-a]pyridin-2(3H)-yl}acetyl)amino]benzoate
Catalog ID
STL078846
SMILES COC(=O)c1ccc(cc1)NC(=O)Cn1nc2n(c1=O)cccc2c1onc(n1)c1ccc(cc1)C
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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 C25H20N6O5 MW 484.47 g/mol Purity >90% as per NMR
InChI
InChI=1S/C25H20N6O5/c1-15-5-7-16(8-6-15)21-27-23(36-29-21)19-4-3-13-30-22(19)28-31(25(30)34)14-20(32)26-18-11-9-17(10-12-18)24(33)35-2/h3-13H,14H2,1-2H3,(H,26,32)InChIKey
NERNADHJQPSXNO-UHFFFAOYSA-NSynonyms
CC1=CC=C(C=C1)C2=NOC(=N2)C3=CC=CN4C3=NN(C4=O)CC(=O)NC5=CC=C(C=C5)C(=O)OC
InChI=1SC25H20N6O5c1155716(8615)212723(362921)1943133022(19)2831(25(30)34)1420(32)261811917(101218)24(33)352h313H14H212H3(H2632)
methyl4(((8(3(4methylphenyl)124oxadiazol5yl)3oxo(124)triazolo(43a)pyridin2(3H)yl)acetyl)amino)benzoate
methyl4((2(8(3(4methylphenyl)124oxadiazol5yl)3oxo(124)triazolo(43a)pyridin2yl)acetyl)amino)benzoate
MFCD18200054
ZINC000067219097
ZINC67219097
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