Vitas-M small molecule compound
N-[3-(1H-imidazol-1-yl)propyl]-3-[(4-nitro-1H-pyrazol-1-yl)methyl]-1,2,4-oxadiazole-5-carboxamide
Catalog ID
STK781346
SMILES O=C(c1onc(n1)Cn1ncc(c1)[N+](=O)[O-])NCCCn1cncc1
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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 C13H14N8O4 MW 346.31 g/mol Purity >90% as per NMR
InChI
InChI=1S/C13H14N8O4/c22-12(15-2-1-4-19-5-3-14-9-19)13-17-11(18-25-13)8-20-7-10(6-16-20)21(23)24/h3,5-7,9H,1-2,4,8H2,(H,15,22)InChIKey
BWPSYIXXSHYAAQ-UHFFFAOYSA-NSynonyms
C1=CN(C=N1)CCCNC(=O)C2=NC(=NO2)CN3C=C(C=N3)(N+)(=O)(O)
InChI=1SC13H14N8O4c2212(15214195314919)131711(182513)820710(61620)21(23)24h3579H1248H2(H1522)
MFCD06014934
N(3(1Himidazol1yl)propyl)3((4nitro1Hpyrazol1yl)methyl)124oxadiazole5carboxamide
N(3IMIDAZOL1YLPROPYL)3((4NITROPYRAZOL1YL)METHYL)124OXADIAZOLE5CARBOXAMIDE
O=C(c1onc(n1)Cn1ncc(c1)(N+)(=O)(O))NCCCn1cncc1
ZINC000012360639
ZINC12360639
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