1-ethyl-6-fluoranyl-7-(4-methylpiperazin-1-yl)-3-(6-nitro-1,3-benzothiazol-2-yl)quinolin-4-one

Systemtic Name: 1-ethyl-6-fluoranyl-7-(4-methylpiperazin-1-yl)-3-(6-nitro-1,3-benzothiazol-2-yl)quinolin-4-one Openeye Name: 1-ethyl-6-fluoro-7-(4-methylpiperazin-1-yl)-3-(6-nitro-1,3-benzothiazol-2-yl)quinolin-4-one CAS Name: 1-ethyl-6-fluoro-7-(4-methyl-1-piperazinyl)-3-(6-nitro-1,3-benzothiazol-2-yl)-4-quinolinone IUPAC Name: 1-ethyl-6-fluoro-7-(4-methylpiperazin-1-yl)-3-(6-nitro-1,3-benzothiazol-2-yl)quinolin-4-one Traditional Name: 1-ethyl-6-fluoro-7-(4-methylpiperazino)-3-(6-nitro-1,3-benzothiazol-2-yl)-4-quinolone Formula: C23H22FN5O3S MolecularWeight: 467.515883

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Descriptors Computed from Structure

Canonical SMILES:

CCN1C=C(C(=O)C2=CC(=C(C=C21)N3CCN(CC3)C)F)C4=NC5=C(S4)C=C(C=C5)[N+](=O)[O-]

Isomeric SMILES

CCN1C=C(C(=O)C2=CC(=C(C=C21)N3CCN(CC3)C)F)C4=NC5=C(S4)C=C(C=C5)[N+](=O)[O-]

InChI

InChI=1S/C23H22FN5O3S/c1-3-27-13-16(23-25-18-5-4-14(29(31)32)10-21(18)33-23)22(30)15-11-17(24)20(12-19(15)27)28-8-6-26(2)7-9-28/h4-5,10-13H,3,6-9H2,1-2H3