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1,3-Diphenyl-2-sulfanylidene-5-(thiophen-2-ylmethylidene)-1,3-diazinane-4,6-dione

View entire compound with spectra: 1 NMR, and 1 MS (GC)

1,3-Diphenyl-2-sulfanylidene-5-(thiophen-2-ylmethylidene)-1,3-diazinane-4,6-dione
SpectraBase Compound ID Hx37CUSMF3j
InChI InChI=1S/C21H14N2O2S2/c24-19-18(14-17-12-7-13-27-17)20(25)23(16-10-5-2-6-11-16)21(26)22(19)15-8-3-1-4-9-15/h1-14H
InChIKey JFLHZEZAJUDMCH-UHFFFAOYSA-N
Mol Weight 390.48 g/mol
Molecular Formula C21H14N2O2S2
Exact Mass 390.04967 g/mol

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

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SpectraBase Spectrum ID CPtlA6sSTlc
Name 1,3-Diphenyl-2-sulfanylidene-5-(thiophen-2-ylmethylidene)-1,3-diazinane-4,6-dione
Comments Computed using HOSE algorithm
Copyright Copyright © 2024-2025 John Wiley & Sons, Inc. All Rights Reserved.
Exact Mass 390.049670045 u
Formula C21H14N2O2S2
InChI InChI=1S/C21H14N2O2S2/c24-19-18(14-17-12-7-13-27-17)20(25)23(16-10-5-2-6-11-16)21(26)22(19)15-8-3-1-4-9-15/h1-14H
InChIKey JFLHZEZAJUDMCH-UHFFFAOYSA-N
Molecular Weight 390.475 g/mol
SMILES C1(N(C(=O)C(C(N1C=1C=CC=CC1)=O)=CC=1SC=CC1)C1=CC=CC=C1)=S