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4-{[(4-chloroanilino)carbonyl]amino}-N-(6-methoxy-4-pyrimidinyl)benzenesulfonamide

View entire compound with spectra: 2 NMR

4-{[(4-chloroanilino)carbonyl]amino}-N-(6-methoxy-4-pyrimidinyl)benzenesulfonamide
SpectraBase Compound ID AZrxEhmHTaw
InChI InChI=1S/C18H16ClN5O4S/c1-28-17-10-16(20-11-21-17)24-29(26,27)15-8-6-14(7-9-15)23-18(25)22-13-4-2-12(19)3-5-13/h2-11H,1H3,(H,20,21,24)(H2,22,23,25)
InChIKey QWQKZWFWRCFYAO-UHFFFAOYSA-N
Mol Weight 433.87 g/mol
Molecular Formula C18H16ClN5O4S
Exact Mass 433.061153 g/mol

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

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SpectraBase Spectrum ID DU8wp99iHzW
Name 4-{[(4-chloroanilino)carbonyl]amino}-N-(6-methoxy-4-pyrimidinyl)benzenesulfonamide
Comments Computed using HOSE algorithm
Copyright Copyright © 2024-2025 John Wiley & Sons, Inc. All Rights Reserved.
Exact Mass 433.061152885 u
Formula C18H16ClN5O4S
InChI InChI=1S/C18H16ClN5O4S/c1-28-17-10-16(20-11-21-17)24-29(26,27)15-8-6-14(7-9-15)23-18(25)22-13-4-2-12(19)3-5-13/h2-11H,1H3,(H,20,21,24)(H2,22,23,25)
InChIKey QWQKZWFWRCFYAO-UHFFFAOYSA-N
Molecular Weight 433.870 g/mol
SMILES N(C(=O)NC1=CC=C(S(NC=2N=CN=C(C2)OC)(=O)=O)C=C1)C1=CC=C(C=C1)Cl