N-(3-methylbutan-2-yl)-2-phenyl-3-[(4-propan-2-ylpiperazin-1-yl)methyl]quinoline-4-carboxamide

Systemtic Name: N-(3-methylbutan-2-yl)-2-phenyl-3-[(4-propan-2-ylpiperazin-1-yl)methyl]quinoline-4-carboxamide Openeye Name: N-(1,2-dimethylpropyl)-3-[(4-isopropylpiperazin-1-yl)methyl]-2-phenyl-quinoline-4-carboxamide CAS Name: N-(3-methylbutan-2-yl)-2-phenyl-3-[(4-propan-2-yl-1-piperazinyl)methyl]-4-quinolinecarboxamide IUPAC Name: N-(3-methylbutan-2-yl)-2-phenyl-3-[(4-propan-2-ylpiperazin-1-yl)methyl]quinoline-4-carboxamide Traditional Name: N-(1,2-dimethylpropyl)-3-[(4-isopropylpiperazino)methyl]-2-phenyl-cinchoninamide Formula: C29H38N4O MolecularWeight: 458.63822

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)C(C)NC(=O)C1=C(C(=NC2=CC=CC=C21)C3=CC=CC=C3)CN4CCN(CC4)C(C)C

Isomeric SMILES

CC(C)C(C)NC(=O)C1=C(C(=NC2=CC=CC=C21)C3=CC=CC=C3)CN4CCN(CC4)C(C)C

InChI

InChI=1S/C29H38N4O/c1-20(2)22(5)30-29(34)27-24-13-9-10-14-26(24)31-28(23-11-7-6-8-12-23)25(27)19-32-15-17-33(18-16-32)21(3)4/h6-14,20-22H,15-19H2,1-5H3,(H,30,34)