N-[3-(pyridin-3-ylmethylcarbamoyl)phenyl]-2,3,4,5-tetrahydro-1-benzazepine-1-carboxamide

Systemtic Name: N-[3-(pyridin-3-ylmethylcarbamoyl)phenyl]-2,3,4,5-tetrahydro-1-benzazepine-1-carboxamide Openeye Name: N-[3-(3-pyridylmethylcarbamoyl)phenyl]-2,3,4,5-tetrahydro-1-benzazepine-1-carboxamide CAS Name: N-[3-[oxo-(3-pyridinylmethylamino)methyl]phenyl]-2,3,4,5-tetrahydro-1-benzazepine-1-carboxamide IUPAC Name: N-[3-(pyridin-3-ylmethylcarbamoyl)phenyl]-2,3,4,5-tetrahydro-1-benzazepine-1-carboxamide Traditional Name: N-[3-(3-pyridylmethylcarbamoyl)phenyl]-2,3,4,5-tetrahydro-1-benzazepine-1-carboxamide Formula: C24H24N4O2 MolecularWeight: 400.47296

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Descriptors Computed from Structure

Canonical SMILES:

C1CCN(C2=CC=CC=C2C1)C(=O)NC3=CC=CC(=C3)C(=O)NCC4=CN=CC=C4

Isomeric SMILES

C1CCN(C2=CC=CC=C2C1)C(=O)NC3=CC=CC(=C3)C(=O)NCC4=CN=CC=C4

InChI

InChI=1S/C24H24N4O2/c29-23(26-17-18-7-6-13-25-16-18)20-10-5-11-21(15-20)27-24(30)28-14-4-3-9-19-8-1-2-12-22(19)28/h1-2,5-8,10-13,15-16H,3-4,9,14,17H2,(H,26,29)(H,27,30)