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

Systemtic Name: 1-(3-bromophenyl)-N-(pyridin-3-ylmethyl)-9H-pyrido[3,4-b]indole-3-carboxamide Openeye Name: 1-(3-bromophenyl)-N-(3-pyridylmethyl)-9H-pyrido[3,4-b]indole-3-carboxamide CAS Name: 1-(3-bromophenyl)-N-(3-pyridinylmethyl)-9H-pyrido[3,4-b]indole-3-carboxamide IUPAC Name: 1-(3-bromophenyl)-N-(pyridin-3-ylmethyl)-9H-pyrido[3,4-b]indole-3-carboxamide Traditional Name: 1-(3-bromophenyl)-N-(3-pyridylmethyl)-9H-$b-carboline-3-carboxamide Formula: C24H17BrN4O MolecularWeight: 457.32198

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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)NCC5=CN=CC=C5

Isomeric SMILES

C1=CC=C2C(=C1)C3=CC(=NC(=C3N2)C4=CC(=CC=C4)Br)C(=O)NCC5=CN=CC=C5

InChI

InChI=1S/C24H17BrN4O/c25-17-7-3-6-16(11-17)22-23-19(18-8-1-2-9-20(18)28-23)12-21(29-22)24(30)27-14-15-5-4-10-26-13-15/h1-13,28H,14H2,(H,27,30)