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

Systemtic Name: 2-(6-fluoranyl-4-oxidanylidene-quinazolin-3-yl)-N-(3-piperidin-1-ylsulfonylphenyl)ethanamide Openeye Name: 2-(6-fluoro-4-oxo-quinazolin-3-yl)-N-[3-(1-piperidylsulfonyl)phenyl]acetamide CAS Name: 2-(6-fluoro-4-oxo-3-quinazolinyl)-N-[3-(1-piperidinylsulfonyl)phenyl]acetamide IUPAC Name: 2-(6-fluoro-4-oxoquinazolin-3-yl)-N-(3-piperidin-1-ylsulfonylphenyl)acetamide Traditional Name: 2-(6-fluoro-4-keto-quinazolin-3-yl)-N-(3-piperidinosulfonylphenyl)acetamide Formula: C21H21FN4O4S MolecularWeight: 444.479243

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C21H21FN4O4S/c22-15-7-8-19-18(11-15)21(28)25(14-23-19)13-20(27)24-16-5-4-6-17(12-16)31(29,30)26-9-2-1-3-10-26/h4-8,11-12,14H,1-3,9-10,13H2,(H,24,27)