1-[3-[(6-morpholin-4-ylsulfonylquinolin-2-yl)amino]phenyl]ethanone

Systemtic Name: 1-[3-[(6-morpholin-4-ylsulfonylquinolin-2-yl)amino]phenyl]ethanone Openeye Name: 1-[3-[(6-morpholinosulfonyl-2-quinolyl)amino]phenyl]ethanone CAS Name: 1-[3-[[6-(4-morpholinylsulfonyl)-2-quinolinyl]amino]phenyl]ethanone IUPAC Name: 1-[3-[(6-morpholin-4-ylsulfonylquinolin-2-yl)amino]phenyl]ethanone Traditional Name: 1-[3-[(6-morpholinosulfonyl-2-quinolyl)amino]phenyl]ethanone Formula: C21H21N3O4S MolecularWeight: 411.47414

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Descriptors Computed from Structure

Canonical SMILES:

CC(=O)C1=CC(=CC=C1)NC2=NC3=C(C=C2)C=C(C=C3)S(=O)(=O)N4CCOCC4

Isomeric SMILES

CC(=O)C1=CC(=CC=C1)NC2=NC3=C(C=C2)C=C(C=C3)S(=O)(=O)N4CCOCC4

InChI

InChI=1S/C21H21N3O4S/c1-15(25)16-3-2-4-18(13-16)22-21-8-5-17-14-19(6-7-20(17)23-21)29(26,27)24-9-11-28-12-10-24/h2-8,13-14H,9-12H2,1H3,(H,22,23)