Vitas-M small molecule compound
3-[(4-chloro-1H-pyrazol-1-yl)methyl]-N-(2-{[(4-nitrophenyl)acetyl]amino}ethyl)-1,2,4-oxadiazole-5-carboxamide
Catalog ID
STK496891
SMILES O=C(Cc1ccc(cc1)[N+](=O)[O-])NCCNC(=O)c1onc(n1)Cn1ncc(c1)Cl
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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 C17H16ClN7O5 MW 433.81 g/mol Purity >90% as per NMR
InChI
InChI=1S/C17H16ClN7O5/c18-12-8-21-24(9-12)10-14-22-17(30-23-14)16(27)20-6-5-19-15(26)7-11-1-3-13(4-2-11)25(28)29/h1-4,8-9H,5-7,10H2,(H,19,26)(H,20,27)InChIKey
QWCONGJTXFCTOC-UHFFFAOYSA-NSynonyms
1006580-78-41006580784
3((4chloro1Hpyrazol1yl)methyl)N(2(((4nitrophenyl)acetyl)amino)ethyl)124oxadiazole5carboxamide
3((4chloropyrazol1yl)methyl)N(2((2(4nitrophenyl)acetyl)amino)ethyl)124oxadiazole5carboxamide
C1=CC(=CC=C1CC(=O)NCCNC(=O)C2=NC(=NO2)CN3C=C(C=N3)Cl)(N+)(=O)(O)
InChI=1SC17H16ClN7O5c181282124(912)10142217(302314)16(27)20651915(26)7111313(4211)25(28)29h1489H5710H2(H1926)(H2027)
MFCD08094615
O=C(Cc1ccc(cc1)(N+)(=O)(O))NCCNC(=O)c1onc(n1)Cn1ncc(c1)Cl
ZINC000020457653
ZINC20457653
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