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

Systemtic Name: N-(3-cyano-5,6,7,8-tetrahydro-4H-cyclohepta[b]thiophen-2-yl)-2-(1-methylbenzimidazol-2-yl)sulfanyl-ethanamide Openeye Name: N-(3-cyano-5,6,7,8-tetrahydro-4H-cyclohepta[b]thiophen-2-yl)-2-(1-methylbenzimidazol-2-yl)sulfanyl-acetamide CAS Name: N-(3-cyano-5,6,7,8-tetrahydro-4H-cyclohepta[b]thiophen-2-yl)-2-[(1-methyl-2-benzimidazolyl)thio]acetamide IUPAC Name: N-(3-cyano-5,6,7,8-tetrahydro-4H-cyclohepta[b]thiophen-2-yl)-2-(1-methylbenzimidazol-2-yl)sulfanylacetamide Traditional Name: N-(3-cyano-5,6,7,8-tetrahydro-4H-cyclohepta[b]thiophen-2-yl)-2-[(1-methylbenzimidazol-2-yl)thio]acetamide Formula: C20H20N4OS2 MolecularWeight: 396.529

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CN1C2=CC=CC=C2N=C1SCC(=O)NC3=C(C4=C(S3)CCCCC4)C#N

Isomeric SMILES

CN1C2=CC=CC=C2N=C1SCC(=O)NC3=C(C4=C(S3)CCCCC4)C#N

InChI

InChI=1S/C20H20N4OS2/c1-24-16-9-6-5-8-15(16)22-20(24)26-12-18(25)23-19-14(11-21)13-7-3-2-4-10-17(13)27-19/h5-6,8-9H,2-4,7,10,12H2,1H3,(H,23,25)