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4-{[4-(1H-indol-3-yl)-1,3-thiazol-2-yl]amino}benzenesulfonamide
SpectraBase Compound ID 297hOJUWIv0
InChI InChI=1S/C17H14N4O2S2/c18-25(22,23)12-7-5-11(6-8-12)20-17-21-16(10-24-17)14-9-19-15-4-2-1-3-13(14)15/h1-10,19H,(H,20,21)(H2,18,22,23)
InChIKey JXMZBTSIFDIMFD-UHFFFAOYSA-N
Mol Weight 370.45 g/mol
Molecular Formula C17H14N4O2S2
Exact Mass 370.055818 g/mol

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

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SpectraBase Spectrum ID 2XlfYYxOk6f
Name 4-{[4-(1H-Indol-3-yl)-1,3-thiazol-2-yl]amino}benzenesulfonamide
Comments Computed using HOSE algorithm
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Exact Mass 370.055818053 u
Formula C17H14N4O2S2
InChI InChI=1S/C17H14N4O2S2/c18-25(22,23)12-7-5-11(6-8-12)20-17-21-16(10-24-17)14-9-19-15-4-2-1-3-13(14)15/h1-10,19H,(H,20,21)(H2,18,22,23)
InChIKey JXMZBTSIFDIMFD-UHFFFAOYSA-N
Molecular Weight 370.445 g/mol
SMILES N(C1=NC(C2=CNC3=C2C=CC=C3)=CS1)C=1C=CC(S(=O)(=O)N)=CC1