N-[3-[4-(3-azanylpropyl)piperazin-1-yl]propyl]-2-(5-bromanyl-1H-indol-3-yl)-6-iodanyl-quinoline-4-carboxamide

Systemtic Name: N-[3-[4-(3-azanylpropyl)piperazin-1-yl]propyl]-2-(5-bromanyl-1H-indol-3-yl)-6-iodanyl-quinoline-4-carboxamide Openeye Name: N-[3-[4-(3-aminopropyl)piperazin-1-yl]propyl]-2-(5-bromo-1H-indol-3-yl)-6-iodo-quinoline-4-carboxamide CAS Name: N-[3-[4-(3-aminopropyl)-1-piperazinyl]propyl]-2-(5-bromo-1H-indol-3-yl)-6-iodo-4-quinolinecarboxamide IUPAC Name: N-[3-[4-(3-aminopropyl)piperazin-1-yl]propyl]-2-(5-bromo-1H-indol-3-yl)-6-iodoquinoline-4-carboxamide Traditional Name: N-[3-[4-(3-aminopropyl)piperazino]propyl]-2-(5-bromo-1H-indol-3-yl)-6-iodo-cinchoninamide Formula: C28H32BrIN6O MolecularWeight: 675.40175

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Descriptors Computed from Structure

Canonical SMILES:

C1CN(CCN1CCCN)CCCNC(=O)C2=CC(=NC3=C2C=C(C=C3)I)C4=CNC5=C4C=C(C=C5)Br

Isomeric SMILES

C1CN(CCN1CCCN)CCCNC(=O)C2=CC(=NC3=C2C=C(C=C3)I)C4=CNC5=C4C=C(C=C5)Br

InChI

InChI=1S/C28H32BrIN6O/c29-19-3-5-25-21(15-19)24(18-33-25)27-17-23(22-16-20(30)4-6-26(22)34-27)28(37)32-8-2-10-36-13-11-35(12-14-36)9-1-7-31/h3-6,15-18,33H,1-2,7-14,31H2,(H,32,37)