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N-(4-{[(2-isopropyl-5-methylphenoxy)acetyl]amino}-2-methoxyphenyl)-2-thiophenecarboxamide

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N-(4-{[(2-isopropyl-5-methylphenoxy)acetyl]amino}-2-methoxyphenyl)-2-thiophenecarboxamide
SpectraBase Compound ID 3spjPALDNpd
InChI InChI=1S/C24H26N2O4S/c1-15(2)18-9-7-16(3)12-20(18)30-14-23(27)25-17-8-10-19(21(13-17)29-4)26-24(28)22-6-5-11-31-22/h5-13,15H,14H2,1-4H3,(H,25,27)(H,26,28)
InChIKey ZZWRVJAJJLTDIG-UHFFFAOYSA-N
Mol Weight 438.54 g/mol
Molecular Formula C24H26N2O4S
Exact Mass 438.161328 g/mol

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

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SpectraBase Spectrum ID LPrz69nF2aC
Name N-(4-{[(2-isopropyl-5-methylphenoxy)acetyl]amino}-2-methoxyphenyl)-2-thiophenecarboxamide
Comments Computed using HOSE algorithm
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Exact Mass 438.161328495 u
Formula C24H26N2O4S
InChI InChI=1S/C24H26N2O4S/c1-15(2)18-9-7-16(3)12-20(18)30-14-23(27)25-17-8-10-19(21(13-17)29-4)26-24(28)22-6-5-11-31-22/h5-13,15H,14H2,1-4H3,(H,25,27)(H,26,28)
InChIKey ZZWRVJAJJLTDIG-UHFFFAOYSA-N
Molecular Weight 438.542 g/mol
SMILES N(C(C=1SC=CC1)=O)C1=CC=C(NC(=O)COC=2C(=CC=C(C2)C)C(C)C)C=C1OC