N-(4-azanylcyclohexyl)-2-(5-bromanyl-1-methyl-indol-3-yl)-7-iodanyl-quinoline-4-carboxamide

Systemtic Name: N-(4-azanylcyclohexyl)-2-(5-bromanyl-1-methyl-indol-3-yl)-7-iodanyl-quinoline-4-carboxamide Openeye Name: N-(4-aminocyclohexyl)-2-(5-bromo-1-methyl-indol-3-yl)-7-iodo-quinoline-4-carboxamide CAS Name: N-(4-aminocyclohexyl)-2-(5-bromo-1-methyl-3-indolyl)-7-iodo-4-quinolinecarboxamide IUPAC Name: N-(4-aminocyclohexyl)-2-(5-bromo-1-methylindol-3-yl)-7-iodoquinoline-4-carboxamide Traditional Name: N-(4-aminocyclohexyl)-2-(5-bromo-1-methyl-indol-3-yl)-7-iodo-cinchoninamide Formula: C25H24BrIN4O MolecularWeight: 603.29273

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Descriptors Computed from Structure

Canonical SMILES:

CN1C=C(C2=C1C=CC(=C2)Br)C3=NC4=C(C=CC(=C4)I)C(=C3)C(=O)NC5CCC(CC5)N

Isomeric SMILES

CN1C=C(C2=C1C=CC(=C2)Br)C3=NC4=C(C=CC(=C4)I)C(=C3)C(=O)NC5CCC(CC5)N

InChI

InChI=1S/C25H24BrIN4O/c1-31-13-21(19-10-14(26)2-9-24(19)31)23-12-20(18-8-3-15(27)11-22(18)30-23)25(32)29-17-6-4-16(28)5-7-17/h2-3,8-13,16-17H,4-7,28H2,1H3,(H,29,32)