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2-({2-[(4-isopropylbenzyl)amino]-2-oxoethyl}sulfanyl)-N-(2-naphthyl)acetamide
SpectraBase Compound ID 3JF3JCxIaP0
InChI InChI=1S/C24H26N2O2S/c1-17(2)19-9-7-18(8-10-19)14-25-23(27)15-29-16-24(28)26-22-12-11-20-5-3-4-6-21(20)13-22/h3-13,17H,14-16H2,1-2H3,(H,25,27)(H,26,28)
InChIKey KQNBZYSKIQNPBT-UHFFFAOYSA-N
Mol Weight 406.54 g/mol
Molecular Formula C24H26N2O2S
Exact Mass 406.171499 g/mol

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

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SpectraBase Spectrum ID E3ZSqRlhwNl
Name 2-({2-[(4-Isopropylbenzyl)amino]-2-oxoethyl}sulfanyl)-N-(2-naphthyl)acetamide
Comments Computed using HOSE algorithm
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Exact Mass 406.171499257 u
Formula C24H26N2O2S
InChI InChI=1S/C24H26N2O2S/c1-17(2)19-9-7-18(8-10-19)14-25-23(27)15-29-16-24(28)26-22-12-11-20-5-3-4-6-21(20)13-22/h3-13,17H,14-16H2,1-2H3,(H,25,27)(H,26,28)
InChIKey KQNBZYSKIQNPBT-UHFFFAOYSA-N
Molecular Weight 406.544 g/mol
SMILES C(NC=1C=C2C=CC=CC2=CC1)(=O)CSCC(NCC1=CC=C(C=C1)C(C)C)=O