2-[4-[4-[(3-chloranyl-4-fluoranyl-phenyl)amino]quinazolin-6-yl]sulfonylpiperazin-1-yl]-N-oxidanyl-pyrimidine-5-carboxamide

Systemtic Name: 2-[4-[4-[(3-chloranyl-4-fluoranyl-phenyl)amino]quinazolin-6-yl]sulfonylpiperazin-1-yl]-N-oxidanyl-pyrimidine-5-carboxamide Openeye Name: 2-[4-[4-(3-chloro-4-fluoro-anilino)quinazolin-6-yl]sulfonylpiperazin-1-yl]pyrimidine-5-carbohydroxamic acid CAS Name: 2-[4-[[4-(3-chloro-4-fluoroanilino)-6-quinazolinyl]sulfonyl]-1-piperazinyl]-N-hydroxy-5-pyrimidinecarboxamide IUPAC Name: 2-[4-[4-(3-chloro-4-fluoroanilino)quinazolin-6-yl]sulfonylpiperazin-1-yl]-N-hydroxypyrimidine-5-carboxamide Traditional Name: 2-[4-[4-(3-chloro-4-fluoro-anilino)quinazolin-6-yl]sulfonylpiperazino]pyrimidine-5-carbohydroxamic acid Formula: C23H20ClFN8O4S MolecularWeight: 558.972503

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Descriptors Computed from Structure

Canonical SMILES:

C1CN(CCN1C2=NC=C(C=N2)C(=O)NO)S(=O)(=O)C3=CC4=C(C=C3)N=CN=C4NC5=CC(=C(C=C5)F)Cl

Isomeric SMILES

C1CN(CCN1C2=NC=C(C=N2)C(=O)NO)S(=O)(=O)C3=CC4=C(C=C3)N=CN=C4NC5=CC(=C(C=C5)F)Cl

InChI

InChI=1S/C23H20ClFN8O4S/c24-18-9-15(1-3-19(18)25)30-21-17-10-16(2-4-20(17)28-13-29-21)38(36,37)33-7-5-32(6-8-33)23-26-11-14(12-27-23)22(34)31-35/h1-4,9-13,35H,5-8H2,(H,31,34)(H,28,29,30)