Vitas-M small molecule compound
3-[(4-bromo-1H-pyrazol-1-yl)methyl]-N-(2-{[(3,4,5-trimethoxyphenyl)carbonyl]amino}ethyl)-1,2,4-oxadiazole-5-carboxamide
Catalog ID
STK689174
SMILES COc1cc(cc(c1OC)OC)C(=O)NCCNC(=O)c1onc(n1)Cn1ncc(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 C19H21BrN6O6 MW 509.32 g/mol Purity >90% as per NMR
InChI
InChI=1S/C19H21BrN6O6/c1-29-13-6-11(7-14(30-2)16(13)31-3)17(27)21-4-5-22-18(28)19-24-15(25-32-19)10-26-9-12(20)8-23-26/h6-9H,4-5,10H2,1-3H3,(H,21,27)(H,22,28)InChIKey
JEDJVFPWQHUISM-UHFFFAOYSA-NSynonyms
3((4bromo1Hpyrazol1yl)methyl)N(2(((345trimethoxyphenyl)carbonyl)amino)ethyl)124oxadiazole5carboxamide
3((4BROMOPYRAZOL1YL)METHYL)N(2((345TRIMETHOXYBENZOYL)AMINO)ETHYL)124OXADIAZOLE5CARBOXAMIDE
COC1=CC(=CC(=C1OC)OC)C(=O)NCCNC(=O)C2=NC(=NO2)CN3C=C(C=N3)Br
InChI=1SC19H21BrN6O6c12913611(714(302)16(13)313)17(27)21452218(28)192415(253219)1026912(20)82326h69H4510H213H3(H2127)(H2228)
MFCD07800689
ZINC000012418547
ZINC12418547
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