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N-(3-methoxyphenyl)-N'-[5-(3-propoxyphenyl)-1,3,4-thiadiazol-2-yl]urea
SpectraBase Compound ID A4YAOx4Rwru
InChI InChI=1S/C19H20N4O3S/c1-3-10-26-16-9-4-6-13(11-16)17-22-23-19(27-17)21-18(24)20-14-7-5-8-15(12-14)25-2/h4-9,11-12H,3,10H2,1-2H3,(H2,20,21,23,24)
InChIKey FNZFKHQMOSSEJZ-UHFFFAOYSA-N
Mol Weight 384.45 g/mol
Molecular Formula C19H20N4O3S
Exact Mass 384.125612 g/mol

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

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SpectraBase Spectrum ID JTLw9GWWUpm
Name N-(3-Methoxyphenyl)-N'-[5-(3-propoxyphenyl)-1,3,4-thiadiazol-2-yl]urea
Comments Computed using HOSE algorithm
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Exact Mass 384.125611691 u
Formula C19H20N4O3S
InChI InChI=1S/C19H20N4O3S/c1-3-10-26-16-9-4-6-13(11-16)17-22-23-19(27-17)21-18(24)20-14-7-5-8-15(12-14)25-2/h4-9,11-12H,3,10H2,1-2H3,(H2,20,21,23,24)
InChIKey FNZFKHQMOSSEJZ-UHFFFAOYSA-N
Molecular Weight 384.454 g/mol
SMILES N(C=1SC(=NN1)C1=CC(OCCC)=CC=C1)C(NC=1C=C(OC)C=CC1)=O