2-(1-cyclohexyl-4,5-dimethyl-imidazol-2-yl)sulfanyl-1-(4-phenylpiperazin-1-yl)propan-1-one

Systemtic Name: 2-(1-cyclohexyl-4,5-dimethyl-imidazol-2-yl)sulfanyl-1-(4-phenylpiperazin-1-yl)propan-1-one Openeye Name: 2-(1-cyclohexyl-4,5-dimethyl-imidazol-2-yl)sulfanyl-1-(4-phenylpiperazin-1-yl)propan-1-one CAS Name: 2-[(1-cyclohexyl-4,5-dimethyl-2-imidazolyl)thio]-1-(4-phenyl-1-piperazinyl)-1-propanone IUPAC Name: 2-(1-cyclohexyl-4,5-dimethylimidazol-2-yl)sulfanyl-1-(4-phenylpiperazin-1-yl)propan-1-one Traditional Name: 2-[(1-cyclohexyl-4,5-dimethyl-imidazol-2-yl)thio]-1-(4-phenylpiperazino)propan-1-one Formula: C24H34N4OS MolecularWeight: 426.61796

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CC1=C(N(C(=N1)SC(C)C(=O)N2CCN(CC2)C3=CC=CC=C3)C4CCCCC4)C

Isomeric SMILES

CC1=C(N(C(=N1)SC(C)C(=O)N2CCN(CC2)C3=CC=CC=C3)C4CCCCC4)C

InChI

InChI=1S/C24H34N4OS/c1-18-19(2)28(22-12-8-5-9-13-22)24(25-18)30-20(3)23(29)27-16-14-26(15-17-27)21-10-6-4-7-11-21/h4,6-7,10-11,20,22H,5,8-9,12-17H2,1-3H3