2-(1-azanyl-4-phenyl-imidazol-2-yl)sulfanyl-N-(3-cyano-5,6,7,8-tetrahydro-4H-cyclohepta[b]thiophen-2-yl)ethanamide

Systemtic Name: 2-(1-azanyl-4-phenyl-imidazol-2-yl)sulfanyl-N-(3-cyano-5,6,7,8-tetrahydro-4H-cyclohepta[b]thiophen-2-yl)ethanamide Openeye Name: 2-(1-amino-4-phenyl-imidazol-2-yl)sulfanyl-N-(3-cyano-5,6,7,8-tetrahydro-4H-cyclohepta[b]thiophen-2-yl)acetamide CAS Name: 2-[(1-amino-4-phenyl-2-imidazolyl)thio]-N-(3-cyano-5,6,7,8-tetrahydro-4H-cyclohepta[b]thiophen-2-yl)acetamide IUPAC Name: 2-(1-amino-4-phenylimidazol-2-yl)sulfanyl-N-(3-cyano-5,6,7,8-tetrahydro-4H-cyclohepta[b]thiophen-2-yl)acetamide Traditional Name: 2-[(1-amino-4-phenyl-imidazol-2-yl)thio]-N-(3-cyano-5,6,7,8-tetrahydro-4H-cyclohepta[b]thiophen-2-yl)acetamide Formula: C21H21N5OS2 MolecularWeight: 423.55434

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

C1CCC2=C(CC1)SC(=C2C#N)NC(=O)CSC3=NC(=CN3N)C4=CC=CC=C4

Isomeric SMILES

C1CCC2=C(CC1)SC(=C2C#N)NC(=O)CSC3=NC(=CN3N)C4=CC=CC=C4

InChI

InChI=1S/C21H21N5OS2/c22-11-16-15-9-5-2-6-10-18(15)29-20(16)25-19(27)13-28-21-24-17(12-26(21)23)14-7-3-1-4-8-14/h1,3-4,7-8,12H,2,5-6,9-10,13,23H2,(H,25,27)