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5-(4-bromophenyl)-N-{[2-(4-chlorobenzoyl)hydrazino]carbothioyl}-2-furamide

View entire compound with spectra: 2 NMR

5-(4-bromophenyl)-N-{[2-(4-chlorobenzoyl)hydrazino]carbothioyl}-2-furamide
SpectraBase Compound ID HS1NffmDACR
InChI InChI=1S/C19H13BrClN3O3S/c20-13-5-1-11(2-6-13)15-9-10-16(27-15)18(26)22-19(28)24-23-17(25)12-3-7-14(21)8-4-12/h1-10H,(H,23,25)(H2,22,24,26,28)
InChIKey RRMSSFAGVZUUPP-UHFFFAOYSA-N
Mol Weight 478.75 g/mol
Molecular Formula C19H13BrClN3O3S
Exact Mass 476.954953 g/mol

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

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SpectraBase Spectrum ID 583E1Dt0G5Y
Name 5-(4-Bromophenyl)-N-{[2-(4-chlorobenzoyl)hydrazino]carbothioyl}-2-furamide
Comments Computed using HOSE algorithm
Copyright Copyright © 2024-2025 John Wiley & Sons, Inc. All Rights Reserved.
Exact Mass 476.954953162 u
Formula C19H13BrClN3O3S
InChI InChI=1S/C19H13BrClN3O3S/c20-13-5-1-11(2-6-13)15-9-10-16(27-15)18(26)22-19(28)24-23-17(25)12-3-7-14(21)8-4-12/h1-10H,(H,23,25)(H2,22,24,26,28)
InChIKey RRMSSFAGVZUUPP-UHFFFAOYSA-N
Molecular Weight 478.748 g/mol
SMILES N(C(C1=CC=C(C=C1)Cl)=O)NC(NC(C=1OC(C=2C=CC(=CC2)Br)=CC1)=O)=S