2-(4-methylquinolin-2-yl)sulfanyl-1-(4-phenylpiperazin-1-yl)ethanone

Systemtic Name: 2-(4-methylquinolin-2-yl)sulfanyl-1-(4-phenylpiperazin-1-yl)ethanone Openeye Name: 2-[(4-methyl-2-quinolyl)sulfanyl]-1-(4-phenylpiperazin-1-yl)ethanone CAS Name: 2-[(4-methyl-2-quinolinyl)thio]-1-(4-phenyl-1-piperazinyl)ethanone IUPAC Name: 2-(4-methylquinolin-2-yl)sulfanyl-1-(4-phenylpiperazin-1-yl)ethanone Traditional Name: 2-[(4-methyl-2-quinolyl)thio]-1-(4-phenylpiperazino)ethanone Formula: C22H23N3OS MolecularWeight: 377.50252

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CC1=CC(=NC2=CC=CC=C12)SCC(=O)N3CCN(CC3)C4=CC=CC=C4

Isomeric SMILES

CC1=CC(=NC2=CC=CC=C12)SCC(=O)N3CCN(CC3)C4=CC=CC=C4

InChI

InChI=1S/C22H23N3OS/c1-17-15-21(23-20-10-6-5-9-19(17)20)27-16-22(26)25-13-11-24(12-14-25)18-7-3-2-4-8-18/h2-10,15H,11-14,16H2,1H3