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

Systemtic Name: N-(2-azanylethyl)-2-(5-bromanyl-1H-indol-3-yl)-7-iodanyl-quinoline-4-carboxamide Openeye Name: N-(2-aminoethyl)-2-(5-bromo-1H-indol-3-yl)-7-iodo-quinoline-4-carboxamide CAS Name: N-(2-aminoethyl)-2-(5-bromo-1H-indol-3-yl)-7-iodo-4-quinolinecarboxamide IUPAC Name: N-(2-aminoethyl)-2-(5-bromo-1H-indol-3-yl)-7-iodoquinoline-4-carboxamide Traditional Name: N-(2-aminoethyl)-2-(5-bromo-1H-indol-3-yl)-7-iodo-cinchoninamide Formula: C20H16BrIN4O MolecularWeight: 535.17571

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC2=C(C=C1Br)C(=CN2)C3=NC4=C(C=CC(=C4)I)C(=C3)C(=O)NCCN

Isomeric SMILES

C1=CC2=C(C=C1Br)C(=CN2)C3=NC4=C(C=CC(=C4)I)C(=C3)C(=O)NCCN

InChI

InChI=1S/C20H16BrIN4O/c21-11-1-4-17-14(7-11)16(10-25-17)19-9-15(20(27)24-6-5-23)13-3-2-12(22)8-18(13)26-19/h1-4,7-10,25H,5-6,23H2,(H,24,27)