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1-(4-amino-1,2,5-oxadiazol-3-yl)-N'-{(E)-[4-(dimethylamino)phenyl]methylidene}-5-[(methylanilino)methyl]-1H-1,2,3-triazole-4-carbohydrazide
SpectraBase Compound ID IjM0K2HZfLs
InChI InChI=1S/C22H24N10O2/c1-30(2)16-11-9-15(10-12-16)13-24-26-22(33)19-18(14-31(3)17-7-5-4-6-8-17)32(29-25-19)21-20(23)27-34-28-21/h4-13H,14H2,1-3H3,(H2,23,27)(H,26,33)/b24-13+
InChIKey MDWAUWBBRFVUAH-ZMOGYAJESA-N
Mol Weight 460.5 g/mol
Molecular Formula C22H24N10O2
Exact Mass 460.20837 g/mol

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

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SpectraBase Spectrum ID IcuWVb8XLXd
Name 1-(4-Amino-1,2,5-oxadiazol-3-yl)-N'-{(E)-[4-(dimethylamino)phenyl]methylidene}-5-[(methylanilino)methyl]-1H-1,2,3-triazole-4-carbohydrazide
Comments Computed using HOSE algorithm
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Exact Mass 460.208370051 u
Formula C22H24N10O2
InChI InChI=1S/C22H24N10O2/c1-30(2)16-11-9-15(10-12-16)13-24-26-22(33)19-18(14-31(3)17-7-5-4-6-8-17)32(29-25-19)21-20(23)27-34-28-21/h4-13H,14H2,1-3H3,(H2,23,27)(H,26,33)/b24-13+
InChIKey MDWAUWBBRFVUAH-ZMOGYAJESA-N
Molecular Weight 460.502 g/mol
SMILES NC=1C(N2C(=C(C(N\N=C\C3=CC=C(C=C3)N(C)C)=O)N=N2)CN(C2=CC=CC=C2)C)=NON1