2-[(6-chloranyl-1,2,3,4-tetrahydroacridin-9-yl)sulfanyl]-1-(4-phenylpiperazin-1-yl)ethanone

Systemtic Name: 2-[(6-chloranyl-1,2,3,4-tetrahydroacridin-9-yl)sulfanyl]-1-(4-phenylpiperazin-1-yl)ethanone Openeye Name: 2-[(6-chloro-1,2,3,4-tetrahydroacridin-9-yl)sulfanyl]-1-(4-phenylpiperazin-1-yl)ethanone CAS Name: 2-[(6-chloro-1,2,3,4-tetrahydroacridin-9-yl)thio]-1-(4-phenyl-1-piperazinyl)ethanone IUPAC Name: 2-[(6-chloro-1,2,3,4-tetrahydroacridin-9-yl)sulfanyl]-1-(4-phenylpiperazin-1-yl)ethanone Traditional Name: 2-[(6-chloro-1,2,3,4-tetrahydroacridin-9-yl)thio]-1-(4-phenylpiperazino)ethanone Formula: C25H26ClN3OS MolecularWeight: 452.01144

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Descriptors Computed from Structure

Canonical SMILES:

C1CCC2=NC3=C(C=CC(=C3)Cl)C(=C2C1)SCC(=O)N4CCN(CC4)C5=CC=CC=C5

Isomeric SMILES

C1CCC2=NC3=C(C=CC(=C3)Cl)C(=C2C1)SCC(=O)N4CCN(CC4)C5=CC=CC=C5

InChI

InChI=1S/C25H26ClN3OS/c26-18-10-11-21-23(16-18)27-22-9-5-4-8-20(22)25(21)31-17-24(30)29-14-12-28(13-15-29)19-6-2-1-3-7-19/h1-3,6-7,10-11,16H,4-5,8-9,12-15,17H2