1-(2,3-dimethoxyphenyl)-N-(3-imidazol-1-ylpropyl)-9H-pyrido[3,4-b]indole-3-carboxamide

Systemtic Name: 1-(2,3-dimethoxyphenyl)-N-(3-imidazol-1-ylpropyl)-9H-pyrido[3,4-b]indole-3-carboxamide Openeye Name: 1-(2,3-dimethoxyphenyl)-N-(3-imidazol-1-ylpropyl)-9H-pyrido[3,4-b]indole-3-carboxamide CAS Name: 1-(2,3-dimethoxyphenyl)-N-[3-(1-imidazolyl)propyl]-9H-pyrido[3,4-b]indole-3-carboxamide IUPAC Name: 1-(2,3-dimethoxyphenyl)-N-(3-imidazol-1-ylpropyl)-9H-pyrido[3,4-b]indole-3-carboxamide Traditional Name: 1-(2,3-dimethoxyphenyl)-N-(3-imidazol-1-ylpropyl)-9H-$b-carboline-3-carboxamide Formula: C26H25N5O3 MolecularWeight: 455.5084

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

COC1=CC=CC(=C1OC)C2=C3C(=CC(=N2)C(=O)NCCCN4C=CN=C4)C5=CC=CC=C5N3

Isomeric SMILES

COC1=CC=CC(=C1OC)C2=C3C(=CC(=N2)C(=O)NCCCN4C=CN=C4)C5=CC=CC=C5N3

InChI

InChI=1S/C26H25N5O3/c1-33-22-10-5-8-18(25(22)34-2)23-24-19(17-7-3-4-9-20(17)29-24)15-21(30-23)26(32)28-11-6-13-31-14-12-27-16-31/h3-5,7-10,12,14-16,29H,6,11,13H2,1-2H3,(H,28,32)