1-[4-(diphenylmethyl)piperazin-1-yl]-5-(1-ethyl-4,5-diphenyl-imidazol-2-yl)sulfanyl-pentan-1-one

Systemtic Name: 1-[4-(diphenylmethyl)piperazin-1-yl]-5-(1-ethyl-4,5-diphenyl-imidazol-2-yl)sulfanyl-pentan-1-one Openeye Name: 1-(4-benzhydrylpiperazin-1-yl)-5-(1-ethyl-4,5-diphenyl-imidazol-2-yl)sulfanyl-pentan-1-one CAS Name: 1-[4-(diphenylmethyl)-1-piperazinyl]-5-[(1-ethyl-4,5-diphenyl-2-imidazolyl)thio]-1-pentanone IUPAC Name: 1-(4-benzhydrylpiperazin-1-yl)-5-(1-ethyl-4,5-diphenylimidazol-2-yl)sulfanylpentan-1-one Traditional Name: 1-(4-benzhydrylpiperazino)-5-[(1-ethyl-4,5-diphenyl-imidazol-2-yl)thio]pentan-1-one Formula: C39H42N4OS MolecularWeight: 614.84198

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Descriptors Computed from Structure

Canonical SMILES:

CCN1C(=C(N=C1SCCCCC(=O)N2CCN(CC2)C(C3=CC=CC=C3)C4=CC=CC=C4)C5=CC=CC=C5)C6=CC=CC=C6

Isomeric SMILES

CCN1C(=C(N=C1SCCCCC(=O)N2CCN(CC2)C(C3=CC=CC=C3)C4=CC=CC=C4)C5=CC=CC=C5)C6=CC=CC=C6

InChI

InChI=1S/C39H42N4OS/c1-2-43-38(34-23-13-6-14-24-34)36(31-17-7-3-8-18-31)40-39(43)45-30-16-15-25-35(44)41-26-28-42(29-27-41)37(32-19-9-4-10-20-32)33-21-11-5-12-22-33/h3-14,17-24,37H,2,15-16,25-30H2,1H3