1-(3-bromophenyl)-N-(3-imidazol-1-ylpropyl)-9H-pyrido[3,4-b]indole-3-carboxamide

Systemtic Name: 1-(3-bromophenyl)-N-(3-imidazol-1-ylpropyl)-9H-pyrido[3,4-b]indole-3-carboxamide Openeye Name: 1-(3-bromophenyl)-N-(3-imidazol-1-ylpropyl)-9H-pyrido[3,4-b]indole-3-carboxamide CAS Name: 1-(3-bromophenyl)-N-[3-(1-imidazolyl)propyl]-9H-pyrido[3,4-b]indole-3-carboxamide IUPAC Name: 1-(3-bromophenyl)-N-(3-imidazol-1-ylpropyl)-9H-pyrido[3,4-b]indole-3-carboxamide Traditional Name: 1-(3-bromophenyl)-N-(3-imidazol-1-ylpropyl)-9H-$b-carboline-3-carboxamide Formula: C24H20BrN5O MolecularWeight: 474.3525

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC=C2C(=C1)C3=CC(=NC(=C3N2)C4=CC(=CC=C4)Br)C(=O)NCCCN5C=CN=C5

Isomeric SMILES

C1=CC=C2C(=C1)C3=CC(=NC(=C3N2)C4=CC(=CC=C4)Br)C(=O)NCCCN5C=CN=C5

InChI

InChI=1S/C24H20BrN5O/c25-17-6-3-5-16(13-17)22-23-19(18-7-1-2-8-20(18)28-23)14-21(29-22)24(31)27-9-4-11-30-12-10-26-15-30/h1-3,5-8,10,12-15,28H,4,9,11H2,(H,27,31)