N-isoquinolin-5-yl-4-thiophen-2-yl-butanamide

Systemtic Name: N-isoquinolin-5-yl-4-thiophen-2-yl-butanamide Openeye Name: N-(5-isoquinolyl)-4-(2-thienyl)butanamide CAS Name: N-(5-isoquinolinyl)-4-thiophen-2-ylbutanamide IUPAC Name: N-isoquinolin-5-yl-4-thiophen-2-ylbutanamide Traditional Name: N-(5-isoquinolyl)-4-(2-thienyl)butyramide Formula: C17H16N2OS MolecularWeight: 296.38674

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

C1=CC2=C(C=CN=C2)C(=C1)NC(=O)CCCC3=CC=CS3

Isomeric SMILES

C1=CC2=C(C=CN=C2)C(=C1)NC(=O)CCCC3=CC=CS3

InChI

InChI=1S/C17H16N2OS/c20-17(8-2-5-14-6-3-11-21-14)19-16-7-1-4-13-12-18-10-9-15(13)16/h1,3-4,6-7,9-12H,2,5,8H2,(H,19,20)