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4-Methoxy-N-[4-(2-methoxyphenyl)piperazin-1-yl]carbothioyl-benzamide
SpectraBase Compound ID CWfrccwzA5j
InChI InChI=1S/C20H23N3O3S/c1-25-16-9-7-15(8-10-16)19(24)21-20(27)23-13-11-22(12-14-23)17-5-3-4-6-18(17)26-2/h3-10H,11-14H2,1-2H3,(H,21,24,27)
InChIKey CTISJERZMCJIQA-UHFFFAOYSA-N
Mol Weight 385.48 g/mol
Molecular Formula C20H23N3O3S
Exact Mass 385.146013 g/mol

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

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SpectraBase Spectrum ID 1di69gTU3LL
Name 4-Methoxy-N-[4-(2-methoxyphenyl)piperazin-1-yl]carbothioyl-benzamide
Comments Computed using HOSE algorithm
Copyright Copyright © 2024-2025 John Wiley & Sons, Inc. All Rights Reserved.
Exact Mass 385.146012784 u
Formula C20H23N3O3S
InChI InChI=1S/C20H23N3O3S/c1-25-16-9-7-15(8-10-16)19(24)21-20(27)23-13-11-22(12-14-23)17-5-3-4-6-18(17)26-2/h3-10H,11-14H2,1-2H3,(H,21,24,27)
InChIKey CTISJERZMCJIQA-UHFFFAOYSA-N
Molecular Weight 385.482 g/mol
SMILES C(NC(C1=CC=C(C=C1)OC)=O)(N1CCN(CC1)C1=C(OC)C=CC=C1)=S