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4H-cyclopenta[b]thiophene-3-carboxamide, N-(2,5-dimethoxyphenyl)-5,6-dihydro-2-[[(3-methoxyphenyl)methyl]amino]-
SpectraBase Compound ID 253uWMtJNsu
InChI InChI=1S/C24H26N2O4S/c1-28-16-7-4-6-15(12-16)14-25-24-22(18-8-5-9-21(18)31-24)23(27)26-19-13-17(29-2)10-11-20(19)30-3/h4,6-7,10-13,25H,5,8-9,14H2,1-3H3,(H,26,27)
InChIKey SAIHDSIMWPZOMU-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 71Hf3WBBXLW
Name 4H-Cyclopenta[B]thiophene-3-carboxamide, N-(2,5-dimethoxyphenyl)-5,6-dihydro-2-[[(3-methoxyphenyl)methyl]amino]-
Comments Computed using HOSE algorithm
Copyright Copyright © 2024-2025 John Wiley & Sons, Inc. All Rights Reserved.
Exact Mass 438.161328495 u
Formula C24H26N2O4S
InChI InChI=1S/C24H26N2O4S/c1-28-16-7-4-6-15(12-16)14-25-24-22(18-8-5-9-21(18)31-24)23(27)26-19-13-17(29-2)10-11-20(19)30-3/h4,6-7,10-13,25H,5,8-9,14H2,1-3H3,(H,26,27)
InChIKey SAIHDSIMWPZOMU-UHFFFAOYSA-N
Molecular Weight 438.542 g/mol
SMILES N(C1=C(C(NC=2C=C(OC)C=CC2OC)=O)C2=C(S1)CCC2)CC=1C=C(OC)C=CC1