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

Systemtic Name: N-(1-ethylsulfonylpiperidin-4-yl)-2-(6-fluoranyl-4-oxidanylidene-quinazolin-3-yl)ethanamide Openeye Name: N-(1-ethylsulfonyl-4-piperidyl)-2-(6-fluoro-4-oxo-quinazolin-3-yl)acetamide CAS Name: N-(1-ethylsulfonyl-4-piperidinyl)-2-(6-fluoro-4-oxo-3-quinazolinyl)acetamide IUPAC Name: N-(1-ethylsulfonylpiperidin-4-yl)-2-(6-fluoro-4-oxoquinazolin-3-yl)acetamide Traditional Name: N-(1-esyl-4-piperidyl)-2-(6-fluoro-4-keto-quinazolin-3-yl)acetamide Formula: C17H21FN4O4S MolecularWeight: 396.436443

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Descriptors Computed from Structure

Canonical SMILES:

CCS(=O)(=O)N1CCC(CC1)NC(=O)CN2C=NC3=C(C2=O)C=C(C=C3)F

Isomeric SMILES

CCS(=O)(=O)N1CCC(CC1)NC(=O)CN2C=NC3=C(C2=O)C=C(C=C3)F

InChI

InChI=1S/C17H21FN4O4S/c1-2-27(25,26)22-7-5-13(6-8-22)20-16(23)10-21-11-19-15-4-3-12(18)9-14(15)17(21)24/h3-4,9,11,13H,2,5-8,10H2,1H3,(H,20,23)