2-[2-[4-(3-chlorophenyl)piperazin-1-yl]carbonylphenyl]sulfanyl-N-cyclohexyl-N-methyl-ethanamide

Systemtic Name: 2-[2-[4-(3-chlorophenyl)piperazin-1-yl]carbonylphenyl]sulfanyl-N-cyclohexyl-N-methyl-ethanamide Openeye Name: 2-[2-[4-(3-chlorophenyl)piperazine-1-carbonyl]phenyl]sulfanyl-N-cyclohexyl-N-methyl-acetamide CAS Name: 2-[[2-[[4-(3-chlorophenyl)-1-piperazinyl]-oxomethyl]phenyl]thio]-N-cyclohexyl-N-methylacetamide IUPAC Name: 2-[2-[4-(3-chlorophenyl)piperazine-1-carbonyl]phenyl]sulfanyl-N-cyclohexyl-N-methylacetamide Traditional Name: 2-[[2-[4-(3-chlorophenyl)piperazine-1-carbonyl]phenyl]thio]-N-cyclohexyl-N-methyl-acetamide Formula: C26H32ClN3O2S MolecularWeight: 486.06918

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CN(C1CCCCC1)C(=O)CSC2=CC=CC=C2C(=O)N3CCN(CC3)C4=CC(=CC=C4)Cl

Isomeric SMILES

CN(C1CCCCC1)C(=O)CSC2=CC=CC=C2C(=O)N3CCN(CC3)C4=CC(=CC=C4)Cl

InChI

InChI=1S/C26H32ClN3O2S/c1-28(21-9-3-2-4-10-21)25(31)19-33-24-13-6-5-12-23(24)26(32)30-16-14-29(15-17-30)22-11-7-8-20(27)18-22/h5-8,11-13,18,21H,2-4,9-10,14-17,19H2,1H3