7-ethoxy-4-[(2-fluoranyl-5-methyl-phenyl)amino]-6-(4-propan-2-ylpiperazin-1-yl)quinoline-3-carboxamide

Systemtic Name: 7-ethoxy-4-[(2-fluoranyl-5-methyl-phenyl)amino]-6-(4-propan-2-ylpiperazin-1-yl)quinoline-3-carboxamide Openeye Name: 7-ethoxy-4-(2-fluoro-5-methyl-anilino)-6-(4-isopropylpiperazin-1-yl)quinoline-3-carboxamide CAS Name: 7-ethoxy-4-(2-fluoro-5-methylanilino)-6-(4-propan-2-yl-1-piperazinyl)-3-quinolinecarboxamide IUPAC Name: 7-ethoxy-4-(2-fluoro-5-methylanilino)-6-(4-propan-2-ylpiperazin-1-yl)quinoline-3-carboxamide Traditional Name: 7-ethoxy-4-(2-fluoro-5-methyl-anilino)-6-(4-isopropylpiperazino)quinoline-3-carboxamide Formula: C26H32FN5O2 MolecularWeight: 465.562983

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Descriptors Computed from Structure

Canonical SMILES:

CCOC1=C(C=C2C(=C1)N=CC(=C2NC3=C(C=CC(=C3)C)F)C(=O)N)N4CCN(CC4)C(C)C

Isomeric SMILES

CCOC1=C(C=C2C(=C1)N=CC(=C2NC3=C(C=CC(=C3)C)F)C(=O)N)N4CCN(CC4)C(C)C

InChI

InChI=1S/C26H32FN5O2/c1-5-34-24-14-21-18(13-23(24)32-10-8-31(9-11-32)16(2)3)25(19(15-29-21)26(28)33)30-22-12-17(4)6-7-20(22)27/h6-7,12-16H,5,8-11H2,1-4H3,(H2,28,33)(H,29,30)