N-(2-azanylethyl)-8-bromanyl-2-(5-chloranyl-1H-indol-3-yl)quinoline-4-carboxamide

Systemtic Name: N-(2-azanylethyl)-8-bromanyl-2-(5-chloranyl-1H-indol-3-yl)quinoline-4-carboxamide Openeye Name: N-(2-aminoethyl)-8-bromo-2-(5-chloro-1H-indol-3-yl)quinoline-4-carboxamide CAS Name: N-(2-aminoethyl)-8-bromo-2-(5-chloro-1H-indol-3-yl)-4-quinolinecarboxamide IUPAC Name: N-(2-aminoethyl)-8-bromo-2-(5-chloro-1H-indol-3-yl)quinoline-4-carboxamide Traditional Name: N-(2-aminoethyl)-8-bromo-2-(5-chloro-1H-indol-3-yl)cinchoninamide Formula: C20H16BrClN4O MolecularWeight: 443.72424

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC2=C(C(=C1)Br)N=C(C=C2C(=O)NCCN)C3=CNC4=C3C=C(C=C4)Cl

Isomeric SMILES

C1=CC2=C(C(=C1)Br)N=C(C=C2C(=O)NCCN)C3=CNC4=C3C=C(C=C4)Cl

InChI

InChI=1S/C20H16BrClN4O/c21-16-3-1-2-12-14(20(27)24-7-6-23)9-18(26-19(12)16)15-10-25-17-5-4-11(22)8-13(15)17/h1-5,8-10,25H,6-7,23H2,(H,24,27)