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N-[4-(4-cyclohexylphenyl)-1,3-thiazol-2-yl]-2-thiophenecarboxamide
SpectraBase Compound ID 4CvrT02BANc
InChI InChI=1S/C20H20N2OS2/c23-19(18-7-4-12-24-18)22-20-21-17(13-25-20)16-10-8-15(9-11-16)14-5-2-1-3-6-14/h4,7-14H,1-3,5-6H2,(H,21,22,23)
InChIKey GXPVCRHLSMMESQ-UHFFFAOYSA-N
Mol Weight 368.51 g/mol
Molecular Formula C20H20N2OS2
Exact Mass 368.101706 g/mol

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

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SpectraBase Spectrum ID 8CX8iKIliSX
Name N-[4-(4-Cyclohexylphenyl)-1,3-thiazol-2-yl]-2-thiophenecarboxamide
Comments Computed using HOSE algorithm
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Exact Mass 368.101705619 u
Formula C20H20N2OS2
InChI InChI=1S/C20H20N2OS2/c23-19(18-7-4-12-24-18)22-20-21-17(13-25-20)16-10-8-15(9-11-16)14-5-2-1-3-6-14/h4,7-14H,1-3,5-6H2,(H,21,22,23)
InChIKey GXPVCRHLSMMESQ-UHFFFAOYSA-N
Molecular Weight 368.513 g/mol
SMILES N(C1=NC(=CS1)C=1C=CC(=CC1)C1CCCCC1)C(C=1SC=CC1)=O