N-[3-(3,5-dimethylpyrazol-1-yl)propyl]-7-(4-ethanoylpiperazin-1-yl)-1-ethyl-6-fluoranyl-4-oxidanylidene-quinoline-3-carboxamide

Systemtic Name: N-[3-(3,5-dimethylpyrazol-1-yl)propyl]-7-(4-ethanoylpiperazin-1-yl)-1-ethyl-6-fluoranyl-4-oxidanylidene-quinoline-3-carboxamide Openeye Name: 7-(4-acetylpiperazin-1-yl)-N-[3-(3,5-dimethylpyrazol-1-yl)propyl]-1-ethyl-6-fluoro-4-oxo-quinoline-3-carboxamide CAS Name: 7-(4-acetyl-1-piperazinyl)-N-[3-(3,5-dimethyl-1-pyrazolyl)propyl]-1-ethyl-6-fluoro-4-oxo-3-quinolinecarboxamide IUPAC Name: 7-(4-acetylpiperazin-1-yl)-N-[3-(3,5-dimethylpyrazol-1-yl)propyl]-1-ethyl-6-fluoro-4-oxoquinoline-3-carboxamide Traditional Name: 7-(4-acetylpiperazino)-N-[3-(3,5-dimethylpyrazol-1-yl)propyl]-1-ethyl-6-fluoro-4-keto-quinoline-3-carboxamide Formula: C26H33FN6O3 MolecularWeight: 496.577023

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Descriptors Computed from Structure

Canonical SMILES:

CCN1C=C(C(=O)C2=CC(=C(C=C21)N3CCN(CC3)C(=O)C)F)C(=O)NCCCN4C(=CC(=N4)C)C

Isomeric SMILES

CCN1C=C(C(=O)C2=CC(=C(C=C21)N3CCN(CC3)C(=O)C)F)C(=O)NCCCN4C(=CC(=N4)C)C

InChI

InChI=1S/C26H33FN6O3/c1-5-30-16-21(26(36)28-7-6-8-33-18(3)13-17(2)29-33)25(35)20-14-22(27)24(15-23(20)30)32-11-9-31(10-12-32)19(4)34/h13-16H,5-12H2,1-4H3,(H,28,36)