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2-[(4-Chlorobenzoyl)amino]-5-methyl-4-phenyl-3-thiophenecarboxamide
SpectraBase Compound ID ADdfwp6A1AD
InChI InChI=1S/C19H15ClN2O2S/c1-11-15(12-5-3-2-4-6-12)16(17(21)23)19(25-11)22-18(24)13-7-9-14(20)10-8-13/h2-10H,1H3,(H2,21,23)(H,22,24)
InChIKey WVKGTGXSLCCUCX-UHFFFAOYSA-N
Mol Weight 370.85 g/mol
Molecular Formula C19H15ClN2O2S
Exact Mass 370.054277 g/mol

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

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SpectraBase Spectrum ID 2tbVohqYaWq
Name 2-[(4-Chlorobenzoyl)amino]-5-methyl-4-phenyl-3-thiophenecarboxamide
Comments Computed using HOSE algorithm
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Exact Mass 370.054276603 u
Formula C19H15ClN2O2S
InChI InChI=1S/C19H15ClN2O2S/c1-11-15(12-5-3-2-4-6-12)16(17(21)23)19(25-11)22-18(24)13-7-9-14(20)10-8-13/h2-10H,1H3,(H2,21,23)(H,22,24)
InChIKey WVKGTGXSLCCUCX-UHFFFAOYSA-N
Molecular Weight 370.854 g/mol
SMILES N(C1=C(C(=O)N)C(=C(S1)C)C=1C=CC=CC1)C(C=1C=CC(=CC1)Cl)=O