2-[[5-[(4-chlorophenyl)methylsulfanyl]-1,3,4-thiadiazol-2-yl]sulfanyl]-1-(5,6-dihydrobenzo[b][1]benzazepin-11-yl)ethanone

Systemtic Name: 2-[[5-[(4-chlorophenyl)methylsulfanyl]-1,3,4-thiadiazol-2-yl]sulfanyl]-1-(5,6-dihydrobenzo[b][1]benzazepin-11-yl)ethanone Openeye Name: 2-[[5-[(4-chlorophenyl)methylsulfanyl]-1,3,4-thiadiazol-2-yl]sulfanyl]-1-(5,6-dihydrobenzo[b][1]benzazepin-11-yl)ethanone CAS Name: 2-[[5-[(4-chlorophenyl)methylthio]-1,3,4-thiadiazol-2-yl]thio]-1-(5,6-dihydrobenzo[b][1]benzazepin-11-yl)ethanone IUPAC Name: 2-[[5-[(4-chlorophenyl)methylsulfanyl]-1,3,4-thiadiazol-2-yl]sulfanyl]-1-(5,6-dihydrobenzo[b][1]benzazepin-11-yl)ethanone Traditional Name: 2-[[5-[(4-chlorobenzyl)thio]-1,3,4-thiadiazol-2-yl]thio]-1-(5,6-dihydrobenzo[b][1]benzazepin-11-yl)ethanone Formula: C25H20ClN3OS3 MolecularWeight: 510.0938

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Descriptors Computed from Structure

Canonical SMILES:

C1CC2=CC=CC=C2N(C3=CC=CC=C31)C(=O)CSC4=NN=C(S4)SCC5=CC=C(C=C5)Cl

Isomeric SMILES

C1CC2=CC=CC=C2N(C3=CC=CC=C31)C(=O)CSC4=NN=C(S4)SCC5=CC=C(C=C5)Cl

InChI

InChI=1S/C25H20ClN3OS3/c26-20-13-9-17(10-14-20)15-31-24-27-28-25(33-24)32-16-23(30)29-21-7-3-1-5-18(21)11-12-19-6-2-4-8-22(19)29/h1-10,13-14H,11-12,15-16H2