N-(2-azanylethyl)-2-(5-bromanyl-1-methyl-indol-3-yl)-6-chloranyl-quinoline-4-carboxamide

Systemtic Name: N-(2-azanylethyl)-2-(5-bromanyl-1-methyl-indol-3-yl)-6-chloranyl-quinoline-4-carboxamide Openeye Name: N-(2-aminoethyl)-2-(5-bromo-1-methyl-indol-3-yl)-6-chloro-quinoline-4-carboxamide CAS Name: N-(2-aminoethyl)-2-(5-bromo-1-methyl-3-indolyl)-6-chloro-4-quinolinecarboxamide IUPAC Name: N-(2-aminoethyl)-2-(5-bromo-1-methylindol-3-yl)-6-chloroquinoline-4-carboxamide Traditional Name: N-(2-aminoethyl)-2-(5-bromo-1-methyl-indol-3-yl)-6-chloro-cinchoninamide Formula: C21H18BrClN4O MolecularWeight: 457.75082

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Descriptors Computed from Structure

Canonical SMILES:

CN1C=C(C2=C1C=CC(=C2)Br)C3=NC4=C(C=C(C=C4)Cl)C(=C3)C(=O)NCCN

Isomeric SMILES

CN1C=C(C2=C1C=CC(=C2)Br)C3=NC4=C(C=C(C=C4)Cl)C(=C3)C(=O)NCCN

InChI

InChI=1S/C21H18BrClN4O/c1-27-11-17(15-8-12(22)2-5-20(15)27)19-10-16(21(28)25-7-6-24)14-9-13(23)3-4-18(14)26-19/h2-5,8-11H,6-7,24H2,1H3,(H,25,28)