N-[2-(azepan-1-yl)phenyl]-6-imidazol-1-yl-pyridine-3-carboxamide

Systemtic Name: N-[2-(azepan-1-yl)phenyl]-6-imidazol-1-yl-pyridine-3-carboxamide Openeye Name: N-[2-(azepan-1-yl)phenyl]-6-imidazol-1-yl-pyridine-3-carboxamide CAS Name: N-[2-(1-azepanyl)phenyl]-6-(1-imidazolyl)-3-pyridinecarboxamide IUPAC Name: N-[2-(azepan-1-yl)phenyl]-6-imidazol-1-ylpyridine-3-carboxamide Traditional Name: N-[2-(azepan-1-yl)phenyl]-6-imidazol-1-yl-nicotinamide Formula: C21H23N5O MolecularWeight: 361.44022

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Descriptors Computed from Structure

Canonical SMILES:

C1CCCN(CC1)C2=CC=CC=C2NC(=O)C3=CN=C(C=C3)N4C=CN=C4

Isomeric SMILES

C1CCCN(CC1)C2=CC=CC=C2NC(=O)C3=CN=C(C=C3)N4C=CN=C4

InChI

InChI=1S/C21H23N5O/c27-21(17-9-10-20(23-15-17)26-14-11-22-16-26)24-18-7-3-4-8-19(18)25-12-5-1-2-6-13-25/h3-4,7-11,14-16H,1-2,5-6,12-13H2,(H,24,27)