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

Systemtic Name: 1-[4-(diphenylmethyl)piperazin-1-yl]-5-[1-ethyl-4,5-bis(4-methoxyphenyl)imidazol-2-yl]sulfanyl-pentan-1-one Openeye Name: 1-(4-benzhydrylpiperazin-1-yl)-5-[1-ethyl-4,5-bis(4-methoxyphenyl)imidazol-2-yl]sulfanyl-pentan-1-one CAS Name: 1-[4-(diphenylmethyl)-1-piperazinyl]-5-[[1-ethyl-4,5-bis(4-methoxyphenyl)-2-imidazolyl]thio]-1-pentanone IUPAC Name: 1-(4-benzhydrylpiperazin-1-yl)-5-[1-ethyl-4,5-bis(4-methoxyphenyl)imidazol-2-yl]sulfanylpentan-1-one Traditional Name: 1-(4-benzhydrylpiperazino)-5-[[1-ethyl-4,5-bis(4-methoxyphenyl)imidazol-2-yl]thio]pentan-1-one Formula: C41H46N4O3S MolecularWeight: 674.89394

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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=C(C=C5)OC)C6=CC=C(C=C6)OC

Isomeric SMILES

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

InChI

InChI=1S/C41H46N4O3S/c1-4-45-40(34-20-24-36(48-3)25-21-34)38(31-18-22-35(47-2)23-19-31)42-41(45)49-30-12-11-17-37(46)43-26-28-44(29-27-43)39(32-13-7-5-8-14-32)33-15-9-6-10-16-33/h5-10,13-16,18-25,39H,4,11-12,17,26-30H2,1-3H3