N-[[3-(aminomethyl)cyclohexyl]methyl]-2-(5-bromanyl-1H-indol-3-yl)-6-chloranyl-quinoline-4-carboxamide

Systemtic Name: N-[[3-(aminomethyl)cyclohexyl]methyl]-2-(5-bromanyl-1H-indol-3-yl)-6-chloranyl-quinoline-4-carboxamide Openeye Name: N-[[3-(aminomethyl)cyclohexyl]methyl]-2-(5-bromo-1H-indol-3-yl)-6-chloro-quinoline-4-carboxamide CAS Name: N-[[3-(aminomethyl)cyclohexyl]methyl]-2-(5-bromo-1H-indol-3-yl)-6-chloro-4-quinolinecarboxamide IUPAC Name: N-[[3-(aminomethyl)cyclohexyl]methyl]-2-(5-bromo-1H-indol-3-yl)-6-chloroquinoline-4-carboxamide Traditional Name: N-[[3-(aminomethyl)cyclohexyl]methyl]-2-(5-bromo-1H-indol-3-yl)-6-chloro-cinchoninamide Formula: C26H26BrClN4O MolecularWeight: 525.86784

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Descriptors Computed from Structure

Canonical SMILES:

C1CC(CC(C1)CNC(=O)C2=CC(=NC3=C2C=C(C=C3)Cl)C4=CNC5=C4C=C(C=C5)Br)CN

Isomeric SMILES

C1CC(CC(C1)CNC(=O)C2=CC(=NC3=C2C=C(C=C3)Cl)C4=CNC5=C4C=C(C=C5)Br)CN

InChI

InChI=1S/C26H26BrClN4O/c27-17-4-6-23-19(9-17)22(14-30-23)25-11-21(20-10-18(28)5-7-24(20)32-25)26(33)31-13-16-3-1-2-15(8-16)12-29/h4-7,9-11,14-16,30H,1-3,8,12-13,29H2,(H,31,33)