3-(4-ethylphenyl)sulfonyl-6-fluoranyl-7-(4-methylpiperazin-1-yl)-1-propyl-quinolin-4-one

Systemtic Name: 3-(4-ethylphenyl)sulfonyl-6-fluoranyl-7-(4-methylpiperazin-1-yl)-1-propyl-quinolin-4-one Openeye Name: 3-(4-ethylphenyl)sulfonyl-6-fluoro-7-(4-methylpiperazin-1-yl)-1-propyl-quinolin-4-one CAS Name: 3-(4-ethylphenyl)sulfonyl-6-fluoro-7-(4-methyl-1-piperazinyl)-1-propyl-4-quinolinone IUPAC Name: 3-(4-ethylphenyl)sulfonyl-6-fluoro-7-(4-methylpiperazin-1-yl)-1-propylquinolin-4-one Traditional Name: 3-(4-ethylphenyl)sulfonyl-6-fluoro-7-(4-methylpiperazino)-1-propyl-4-quinolone Formula: C25H30FN3O3S MolecularWeight: 471.587403

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Descriptors Computed from Structure

Canonical SMILES:

CCCN1C=C(C(=O)C2=CC(=C(C=C21)N3CCN(CC3)C)F)S(=O)(=O)C4=CC=C(C=C4)CC

Isomeric SMILES

CCCN1C=C(C(=O)C2=CC(=C(C=C21)N3CCN(CC3)C)F)S(=O)(=O)C4=CC=C(C=C4)CC

InChI

InChI=1S/C25H30FN3O3S/c1-4-10-29-17-24(33(31,32)19-8-6-18(5-2)7-9-19)25(30)20-15-21(26)23(16-22(20)29)28-13-11-27(3)12-14-28/h6-9,15-17H,4-5,10-14H2,1-3H3