1-(5,6-dihydrobenzo[b][1]benzazepin-11-yl)-2-(1,4-diphenylimidazol-2-yl)sulfanyl-ethanone

Systemtic Name: 1-(5,6-dihydrobenzo[b][1]benzazepin-11-yl)-2-(1,4-diphenylimidazol-2-yl)sulfanyl-ethanone Openeye Name: 1-(5,6-dihydrobenzo[b][1]benzazepin-11-yl)-2-(1,4-diphenylimidazol-2-yl)sulfanyl-ethanone CAS Name: 1-(5,6-dihydrobenzo[b][1]benzazepin-11-yl)-2-[(1,4-diphenyl-2-imidazolyl)thio]ethanone IUPAC Name: 1-(5,6-dihydrobenzo[b][1]benzazepin-11-yl)-2-(1,4-diphenylimidazol-2-yl)sulfanylethanone Traditional Name: 1-(5,6-dihydrobenzo[b][1]benzazepin-11-yl)-2-[(1,4-diphenylimidazol-2-yl)thio]ethanone Formula: C31H25N3OS MolecularWeight: 487.6147

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Descriptors Computed from Structure

Canonical SMILES:

C1CC2=CC=CC=C2N(C3=CC=CC=C31)C(=O)CSC4=NC(=CN4C5=CC=CC=C5)C6=CC=CC=C6

Isomeric SMILES

C1CC2=CC=CC=C2N(C3=CC=CC=C31)C(=O)CSC4=NC(=CN4C5=CC=CC=C5)C6=CC=CC=C6

InChI

InChI=1S/C31H25N3OS/c35-30(34-28-17-9-7-13-24(28)19-20-25-14-8-10-18-29(25)34)22-36-31-32-27(23-11-3-1-4-12-23)21-33(31)26-15-5-2-6-16-26/h1-18,21H,19-20,22H2