5-(azepan-1-yl)-4-phenyl-N-(pyridin-3-ylmethyl)thiophene-2-carboxamide

Systemtic Name: 5-(azepan-1-yl)-4-phenyl-N-(pyridin-3-ylmethyl)thiophene-2-carboxamide Openeye Name: 5-(azepan-1-yl)-4-phenyl-N-(3-pyridylmethyl)thiophene-2-carboxamide CAS Name: 5-(1-azepanyl)-4-phenyl-N-(3-pyridinylmethyl)-2-thiophenecarboxamide IUPAC Name: 5-(azepan-1-yl)-4-phenyl-N-(pyridin-3-ylmethyl)thiophene-2-carboxamide Traditional Name: 5-(azepan-1-yl)-4-phenyl-N-(3-pyridylmethyl)thiophene-2-carboxamide Formula: C23H25N3OS MolecularWeight: 391.5291

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

C1CCCN(CC1)C2=C(C=C(S2)C(=O)NCC3=CN=CC=C3)C4=CC=CC=C4

Isomeric SMILES

C1CCCN(CC1)C2=C(C=C(S2)C(=O)NCC3=CN=CC=C3)C4=CC=CC=C4

InChI

InChI=1S/C23H25N3OS/c27-22(25-17-18-9-8-12-24-16-18)21-15-20(19-10-4-3-5-11-19)23(28-21)26-13-6-1-2-7-14-26/h3-5,8-12,15-16H,1-2,6-7,13-14,17H2,(H,25,27)