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4-[3-[1-[2-Pyridyl]ethylidene]hydrazino]carbothioamidobenzenesulfonamide
SpectraBase Compound ID G7BccUmBQAe
InChI InChI=1S/C14H15N5O2S2/c1-10(13-4-2-3-9-16-13)18-19-14(22)17-11-5-7-12(8-6-11)23(15,20)21/h2-9H,1H3,(H2,15,20,21)(H2,17,19,22)/b18-10-
InChIKey BCFCPOLFSAERRD-ZDLGFXPLSA-N
Mol Weight 349.43 g/mol
Molecular Formula C14H15N5O2S2
Exact Mass 349.066717 g/mol

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

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SpectraBase Spectrum ID 2NpBh3NJhhi
Name 4-[3-[1-[2-Pyridyl]ethylidene]hydrazino]carbothioamidobenzenesulfonamide
Comments Computed using HOSE algorithm
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Exact Mass 349.066717089 u
Formula C14H15N5O2S2
InChI InChI=1S/C14H15N5O2S2/c1-10(13-4-2-3-9-16-13)18-19-14(22)17-11-5-7-12(8-6-11)23(15,20)21/h2-9H,1H3,(H2,15,20,21)(H2,17,19,22)/b18-10-
InChIKey BCFCPOLFSAERRD-ZDLGFXPLSA-N
Molecular Weight 349.427 g/mol
SMILES C1=NC(=CC=C1)\C(=N/NC(NC1=CC=C(C=C1)S(=O)(=O)N)=S)C