N-[(4-fluorophenyl)methyl]-6-morpholin-4-ylsulfonyl-4-oxidanylidene-1H-quinoline-3-carboxamide

Systemtic Name: N-[(4-fluorophenyl)methyl]-6-morpholin-4-ylsulfonyl-4-oxidanylidene-1H-quinoline-3-carboxamide Openeye Name: N-[(4-fluorophenyl)methyl]-6-morpholinosulfonyl-4-oxo-1H-quinoline-3-carboxamide CAS Name: N-[(4-fluorophenyl)methyl]-6-(4-morpholinylsulfonyl)-4-oxo-1H-quinoline-3-carboxamide IUPAC Name: N-[(4-fluorophenyl)methyl]-6-morpholin-4-ylsulfonyl-4-oxo-1H-quinoline-3-carboxamide Traditional Name: N-(4-fluorobenzyl)-4-keto-6-morpholinosulfonyl-1H-quinoline-3-carboxamide Formula: C21H20FN3O5S MolecularWeight: 445.464003

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Descriptors Computed from Structure

Canonical SMILES:

C1COCCN1S(=O)(=O)C2=CC3=C(C=C2)NC=C(C3=O)C(=O)NCC4=CC=C(C=C4)F

Isomeric SMILES

C1COCCN1S(=O)(=O)C2=CC3=C(C=C2)NC=C(C3=O)C(=O)NCC4=CC=C(C=C4)F

InChI

InChI=1S/C21H20FN3O5S/c22-15-3-1-14(2-4-15)12-24-21(27)18-13-23-19-6-5-16(11-17(19)20(18)26)31(28,29)25-7-9-30-10-8-25/h1-6,11,13H,7-10,12H2,(H,23,26)(H,24,27)