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

Systemtic Name: 1-[4-(diphenylmethyl)piperazin-1-yl]-4-(1-ethyl-4,5-diphenyl-imidazol-2-yl)sulfanyl-butan-1-one Openeye Name: 1-(4-benzhydrylpiperazin-1-yl)-4-(1-ethyl-4,5-diphenyl-imidazol-2-yl)sulfanyl-butan-1-one CAS Name: 1-[4-(diphenylmethyl)-1-piperazinyl]-4-[(1-ethyl-4,5-diphenyl-2-imidazolyl)thio]-1-butanone IUPAC Name: 1-(4-benzhydrylpiperazin-1-yl)-4-(1-ethyl-4,5-diphenylimidazol-2-yl)sulfanylbutan-1-one Traditional Name: 1-(4-benzhydrylpiperazino)-4-[(1-ethyl-4,5-diphenyl-imidazol-2-yl)thio]butan-1-one Formula: C38H40N4OS MolecularWeight: 600.8154

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Descriptors Computed from Structure

Canonical SMILES:

CCN1C(=C(N=C1SCCCC(=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=C1SCCCC(=O)N2CCN(CC2)C(C3=CC=CC=C3)C4=CC=CC=C4)C5=CC=CC=C5)C6=CC=CC=C6

InChI

InChI=1S/C38H40N4OS/c1-2-42-37(33-22-13-6-14-23-33)35(30-16-7-3-8-17-30)39-38(42)44-29-15-24-34(43)40-25-27-41(28-26-40)36(31-18-9-4-10-19-31)32-20-11-5-12-21-32/h3-14,16-23,36H,2,15,24-29H2,1H3