N-(3-azanyl-2-oxidanyl-propyl)-2-(5-bromanyl-1H-indol-3-yl)-5,7-bis(chloranyl)quinoline-4-carboxamide

Systemtic Name: N-(3-azanyl-2-oxidanyl-propyl)-2-(5-bromanyl-1H-indol-3-yl)-5,7-bis(chloranyl)quinoline-4-carboxamide Openeye Name: N-(3-amino-2-hydroxy-propyl)-2-(5-bromo-1H-indol-3-yl)-5,7-dichloro-quinoline-4-carboxamide CAS Name: N-(3-amino-2-hydroxypropyl)-2-(5-bromo-1H-indol-3-yl)-5,7-dichloro-4-quinolinecarboxamide IUPAC Name: N-(3-amino-2-hydroxypropyl)-2-(5-bromo-1H-indol-3-yl)-5,7-dichloroquinoline-4-carboxamide Traditional Name: N-(3-amino-2-hydroxy-propyl)-2-(5-bromo-1H-indol-3-yl)-5,7-dichloro-cinchoninamide Formula: C21H17BrCl2N4O2 MolecularWeight: 508.19528

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC2=C(C=C1Br)C(=CN2)C3=NC4=CC(=CC(=C4C(=C3)C(=O)NCC(CN)O)Cl)Cl

Isomeric SMILES

C1=CC2=C(C=C1Br)C(=CN2)C3=NC4=CC(=CC(=C4C(=C3)C(=O)NCC(CN)O)Cl)Cl

InChI

InChI=1S/C21H17BrCl2N4O2/c22-10-1-2-17-13(3-10)15(9-26-17)18-6-14(21(30)27-8-12(29)7-25)20-16(24)4-11(23)5-19(20)28-18/h1-6,9,12,26,29H,7-8,25H2,(H,27,30)