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N'-{(E)-[1-(4-chlorophenyl)-1H-pyrrol-2-yl]methylidene}-4-methylbenzenesulfonohydrazide
SpectraBase Compound ID 7Gmn7aoQ9dF
InChI InChI=1S/C18H16ClN3O2S/c1-14-4-10-18(11-5-14)25(23,24)21-20-13-17-3-2-12-22(17)16-8-6-15(19)7-9-16/h2-13,21H,1H3/b20-13+
InChIKey ZBVFPIZLWPNZRY-DEDYPNTBSA-N
Mol Weight 373.86 g/mol
Molecular Formula C18H16ClN3O2S
Exact Mass 373.065176 g/mol

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

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SpectraBase Spectrum ID 8f9CJzDCqEC
Name N'-{(E)-[1-(4-chlorophenyl)-1H-pyrrol-2-yl]methylidene}-4-methylbenzenesulfonohydrazide
Comments Computed using HOSE algorithm
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Exact Mass 373.065175639 u
Formula C18H16ClN3O2S
InChI InChI=1S/C18H16ClN3O2S/c1-14-4-10-18(11-5-14)25(23,24)21-20-13-17-3-2-12-22(17)16-8-6-15(19)7-9-16/h2-13,21H,1H3/b20-13+
InChIKey ZBVFPIZLWPNZRY-DEDYPNTBSA-N
Molecular Weight 373.858 g/mol
SMILES N(S(C1=CC=C(C=C1)C)(=O)=O)\N=C\C=1N(C2=CC=C(C=C2)Cl)C=CC1