2-(6-fluoranyl-4-oxidanylidene-quinazolin-3-yl)-N-[(2-piperidin-1-ylsulfonylphenyl)methyl]ethanamide

Systemtic Name: 2-(6-fluoranyl-4-oxidanylidene-quinazolin-3-yl)-N-[(2-piperidin-1-ylsulfonylphenyl)methyl]ethanamide Openeye Name: 2-(6-fluoro-4-oxo-quinazolin-3-yl)-N-[[2-(1-piperidylsulfonyl)phenyl]methyl]acetamide CAS Name: 2-(6-fluoro-4-oxo-3-quinazolinyl)-N-[[2-(1-piperidinylsulfonyl)phenyl]methyl]acetamide IUPAC Name: 2-(6-fluoro-4-oxoquinazolin-3-yl)-N-[(2-piperidin-1-ylsulfonylphenyl)methyl]acetamide Traditional Name: 2-(6-fluoro-4-keto-quinazolin-3-yl)-N-(2-piperidinosulfonylbenzyl)acetamide Formula: C22H23FN4O4S MolecularWeight: 458.505823

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Descriptors Computed from Structure

Canonical SMILES:

C1CCN(CC1)S(=O)(=O)C2=CC=CC=C2CNC(=O)CN3C=NC4=C(C3=O)C=C(C=C4)F

Isomeric SMILES

C1CCN(CC1)S(=O)(=O)C2=CC=CC=C2CNC(=O)CN3C=NC4=C(C3=O)C=C(C=C4)F

InChI

InChI=1S/C22H23FN4O4S/c23-17-8-9-19-18(12-17)22(29)26(15-25-19)14-21(28)24-13-16-6-2-3-7-20(16)32(30,31)27-10-4-1-5-11-27/h2-3,6-9,12,15H,1,4-5,10-11,13-14H2,(H,24,28)