3-bromanyl-N,1-bis[(3-carbamimidoylphenyl)methyl]indole-2-carboxamide

Systemtic Name: 3-bromanyl-N,1-bis[(3-carbamimidoylphenyl)methyl]indole-2-carboxamide Openeye Name: 3-bromo-N,1-bis[(3-carbamimidoylphenyl)methyl]indole-2-carboxamide CAS Name: 3-bromo-N,1-bis[(3-carbamimidoylphenyl)methyl]-2-indolecarboxamide IUPAC Name: 3-bromo-N,1-bis[(3-carbamimidoylphenyl)methyl]indole-2-carboxamide Traditional Name: N,1-bis(3-amidinobenzyl)-3-bromo-indole-2-carboxamide Formula: C25H23BrN6O MolecularWeight: 503.39372

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC=C2C(=C1)C(=C(N2CC3=CC=CC(=C3)C(=N)N)C(=O)NCC4=CC=CC(=C4)C(=N)N)Br

Isomeric SMILES

C1=CC=C2C(=C1)C(=C(N2CC3=CC=CC(=C3)C(=N)N)C(=O)NCC4=CC=CC(=C4)C(=N)N)Br

InChI

InChI=1S/C25H23BrN6O/c26-21-19-9-1-2-10-20(19)32(14-16-6-4-8-18(12-16)24(29)30)22(21)25(33)31-13-15-5-3-7-17(11-15)23(27)28/h1-12H,13-14H2,(H3,27,28)(H3,29,30)(H,31,33)