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N-(4-{[(4-methyl-2-pyrimidinyl)amino]sulfonyl}phenyl)-2-phenylacetamide
SpectraBase Compound ID IeIIQnoDwzn
InChI InChI=1S/C19H18N4O3S/c1-14-11-12-20-19(21-14)23-27(25,26)17-9-7-16(8-10-17)22-18(24)13-15-5-3-2-4-6-15/h2-12H,13H2,1H3,(H,22,24)(H,20,21,23)
InChIKey ADIGYJPISRQNFC-UHFFFAOYSA-N
Mol Weight 382.44 g/mol
Molecular Formula C19H18N4O3S
Exact Mass 382.109962 g/mol

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

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SpectraBase Spectrum ID E1CTVqg7941
Name N-(4-{[(4-methyl-2-pyrimidinyl)amino]sulfonyl}phenyl)-2-phenylacetamide
Comments Computed using HOSE algorithm
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Exact Mass 382.109961627 u
Formula C19H18N4O3S
InChI InChI=1S/C19H18N4O3S/c1-14-11-12-20-19(21-14)23-27(25,26)17-9-7-16(8-10-17)22-18(24)13-15-5-3-2-4-6-15/h2-12H,13H2,1H3,(H,22,24)(H,20,21,23)
InChIKey ADIGYJPISRQNFC-UHFFFAOYSA-N
Molecular Weight 382.438 g/mol
SMILES N(C(=O)CC1=CC=CC=C1)C=1C=CC(S(NC2=NC(C)=CC=N2)(=O)=O)=CC1