2-(1-cyclopentyl-4,5-dimethyl-imidazol-2-yl)sulfanyl-1-(4-phenylpiperazin-1-yl)ethanone

Systemtic Name: 2-(1-cyclopentyl-4,5-dimethyl-imidazol-2-yl)sulfanyl-1-(4-phenylpiperazin-1-yl)ethanone Openeye Name: 2-(1-cyclopentyl-4,5-dimethyl-imidazol-2-yl)sulfanyl-1-(4-phenylpiperazin-1-yl)ethanone CAS Name: 2-[(1-cyclopentyl-4,5-dimethyl-2-imidazolyl)thio]-1-(4-phenyl-1-piperazinyl)ethanone IUPAC Name: 2-(1-cyclopentyl-4,5-dimethylimidazol-2-yl)sulfanyl-1-(4-phenylpiperazin-1-yl)ethanone Traditional Name: 2-[(1-cyclopentyl-4,5-dimethyl-imidazol-2-yl)thio]-1-(4-phenylpiperazino)ethanone Formula: C22H30N4OS MolecularWeight: 398.5648

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CC1=C(N(C(=N1)SCC(=O)N2CCN(CC2)C3=CC=CC=C3)C4CCCC4)C

Isomeric SMILES

CC1=C(N(C(=N1)SCC(=O)N2CCN(CC2)C3=CC=CC=C3)C4CCCC4)C

InChI

InChI=1S/C22H30N4OS/c1-17-18(2)26(20-10-6-7-11-20)22(23-17)28-16-21(27)25-14-12-24(13-15-25)19-8-4-3-5-9-19/h3-5,8-9,20H,6-7,10-16H2,1-2H3