2-(3-phenylprop-2-ynoylamino)-4,5-dihydrobenzo[g][1]benzothiole-3-carboxamide

Systemtic Name: 2-(3-phenylprop-2-ynoylamino)-4,5-dihydrobenzo[g][1]benzothiole-3-carboxamide Openeye Name: 2-(3-phenylprop-2-ynoylamino)-4,5-dihydrobenzo[g]benzothiophene-3-carboxamide CAS Name: 2-[(1-oxo-3-phenylprop-2-ynyl)amino]-4,5-dihydrobenzo[g][1]benzothiole-3-carboxamide IUPAC Name: 2-(3-phenylprop-2-ynoylamino)-4,5-dihydrobenzo[g][1]benzothiole-3-carboxamide Traditional Name: 2-[(3-phenylpropioloyl)amino]-4,5-dihydrobenzo[g]benzothiophene-3-carboxamide Formula: C22H16N2O2S MolecularWeight: 372.43964

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

C1CC2=C(C3=CC=CC=C31)SC(=C2C(=O)N)NC(=O)C#CC4=CC=CC=C4

Isomeric SMILES

C1CC2=C(C3=CC=CC=C31)SC(=C2C(=O)N)NC(=O)C#CC4=CC=CC=C4

InChI

InChI=1S/C22H16N2O2S/c23-21(26)19-17-12-11-15-8-4-5-9-16(15)20(17)27-22(19)24-18(25)13-10-14-6-2-1-3-7-14/h1-9H,11-12H2,(H2,23,26)(H,24,25)