5-bromanyl-N-[6-(4-methylpiperazin-4-ium-1-yl)pyridin-3-yl]-1H-indole-2-carboxamide

Systemtic Name: 5-bromanyl-N-[6-(4-methylpiperazin-4-ium-1-yl)pyridin-3-yl]-1H-indole-2-carboxamide Openeye Name: 5-bromo-N-[6-(4-methylpiperazin-4-ium-1-yl)-3-pyridyl]-1H-indole-2-carboxamide CAS Name: 5-bromo-N-[6-(4-methyl-1-piperazin-4-iumyl)-3-pyridinyl]-1H-indole-2-carboxamide IUPAC Name: 5-bromo-N-[6-(4-methylpiperazin-4-ium-1-yl)pyridin-3-yl]-1H-indole-2-carboxamide Traditional Name: 5-bromo-N-[6-(4-methylpiperazin-4-ium-1-yl)-3-pyridyl]-1H-indole-2-carboxamide Formula: C19H21BrN5O+ MolecularWeight: 415.30694

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Descriptors Computed from Structure

Canonical SMILES:

C[NH+]1CCN(CC1)C2=NC=C(C=C2)NC(=O)C3=CC4=C(N3)C=CC(=C4)Br

Isomeric SMILES

C[NH+]1CCN(CC1)C2=NC=C(C=C2)NC(=O)C3=CC4=C(N3)C=CC(=C4)Br

InChI

InChI=1S/C19H20BrN5O/c1-24-6-8-25(9-7-24)18-5-3-15(12-21-18)22-19(26)17-11-13-10-14(20)2-4-16(13)23-17/h2-5,10-12,23H,6-9H2,1H3,(H,22,26)/p+1