N-cyclopropyl-N-[[2-(4-ethanoylpiperazin-1-yl)-7-methyl-quinolin-3-yl]methyl]-4-fluoranyl-benzamide

Systemtic Name: N-cyclopropyl-N-[[2-(4-ethanoylpiperazin-1-yl)-7-methyl-quinolin-3-yl]methyl]-4-fluoranyl-benzamide Openeye Name: N-[[2-(4-acetylpiperazin-1-yl)-7-methyl-3-quinolyl]methyl]-N-cyclopropyl-4-fluoro-benzamide CAS Name: N-[[2-(4-acetyl-1-piperazinyl)-7-methyl-3-quinolinyl]methyl]-N-cyclopropyl-4-fluorobenzamide IUPAC Name: N-[[2-(4-acetylpiperazin-1-yl)-7-methylquinolin-3-yl]methyl]-N-cyclopropyl-4-fluorobenzamide Traditional Name: N-[[2-(4-acetylpiperazino)-7-methyl-3-quinolyl]methyl]-N-cyclopropyl-4-fluoro-benzamide Formula: C27H29FN4O2 MolecularWeight: 460.543163

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC2=NC(=C(C=C2C=C1)CN(C3CC3)C(=O)C4=CC=C(C=C4)F)N5CCN(CC5)C(=O)C

Isomeric SMILES

CC1=CC2=NC(=C(C=C2C=C1)CN(C3CC3)C(=O)C4=CC=C(C=C4)F)N5CCN(CC5)C(=O)C

InChI

InChI=1S/C27H29FN4O2/c1-18-3-4-21-16-22(17-32(24-9-10-24)27(34)20-5-7-23(28)8-6-20)26(29-25(21)15-18)31-13-11-30(12-14-31)19(2)33/h3-8,15-16,24H,9-14,17H2,1-2H3