3-cyano-N-(3-thiophen-2-ylcarbonyl-4,5,6,7-tetrahydro-1-benzothiophen-2-yl)benzamide

Systemtic Name: 3-cyano-N-(3-thiophen-2-ylcarbonyl-4,5,6,7-tetrahydro-1-benzothiophen-2-yl)benzamide Openeye Name: 3-cyano-N-[3-(thiophene-2-carbonyl)-4,5,6,7-tetrahydrobenzothiophen-2-yl]benzamide CAS Name: 3-cyano-N-[3-[oxo(thiophen-2-yl)methyl]-4,5,6,7-tetrahydro-1-benzothiophen-2-yl]benzamide IUPAC Name: 3-cyano-N-[3-(thiophene-2-carbonyl)-4,5,6,7-tetrahydro-1-benzothiophen-2-yl]benzamide Traditional Name: 3-cyano-N-[3-(2-thenoyl)-4,5,6,7-tetrahydrobenzothiophen-2-yl]benzamide Formula: C21H16N2O2S2 MolecularWeight: 392.49394

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

C1CCC2=C(C1)C(=C(S2)NC(=O)C3=CC=CC(=C3)C#N)C(=O)C4=CC=CS4

Isomeric SMILES

C1CCC2=C(C1)C(=C(S2)NC(=O)C3=CC=CC(=C3)C#N)C(=O)C4=CC=CS4

InChI

InChI=1S/C21H16N2O2S2/c22-12-13-5-3-6-14(11-13)20(25)23-21-18(19(24)17-9-4-10-26-17)15-7-1-2-8-16(15)27-21/h3-6,9-11H,1-2,7-8H2,(H,23,25)