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Isopropyl 2-(benzoylamino)-4-(4-methoxyphenyl)-3-thiophenecarboxylate

View entire compound with spectra: 2 NMR

Isopropyl 2-(benzoylamino)-4-(4-methoxyphenyl)-3-thiophenecarboxylate
SpectraBase Compound ID H6VCFLKLkhK
InChI InChI=1S/C22H21NO4S/c1-14(2)27-22(25)19-18(15-9-11-17(26-3)12-10-15)13-28-21(19)23-20(24)16-7-5-4-6-8-16/h4-14H,1-3H3,(H,23,24)
InChIKey DPPBMYVZWPPCHD-UHFFFAOYSA-N
Mol Weight 395.47 g/mol
Molecular Formula C22H21NO4S
Exact Mass 395.119129 g/mol

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

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SpectraBase Spectrum ID DhRyZZjRKXS
Name Isopropyl 2-(benzoylamino)-4-(4-methoxyphenyl)-3-thiophenecarboxylate
Comments Computed using HOSE algorithm
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Exact Mass 395.119129330 u
Formula C22H21NO4S
InChI InChI=1S/C22H21NO4S/c1-14(2)27-22(25)19-18(15-9-11-17(26-3)12-10-15)13-28-21(19)23-20(24)16-7-5-4-6-8-16/h4-14H,1-3H3,(H,23,24)
InChIKey DPPBMYVZWPPCHD-UHFFFAOYSA-N
Molecular Weight 395.473 g/mol
SMILES N(C1=C(C(OC(C)C)=O)C(=CS1)C1=CC=C(C=C1)OC)C(=O)C=1C=CC=CC1