4-(1H-benzimidazol-2-ylsulfanyl)-1-[4-(diphenylmethyl)piperazin-1-yl]butane-1,3-dione

Systemtic Name: 4-(1H-benzimidazol-2-ylsulfanyl)-1-[4-(diphenylmethyl)piperazin-1-yl]butane-1,3-dione Openeye Name: 1-(4-benzhydrylpiperazin-1-yl)-4-(1H-benzimidazol-2-ylsulfanyl)butane-1,3-dione CAS Name: 4-(1H-benzimidazol-2-ylthio)-1-[4-(diphenylmethyl)-1-piperazinyl]butane-1,3-dione IUPAC Name: 1-(4-benzhydrylpiperazin-1-yl)-4-(1H-benzimidazol-2-ylsulfanyl)butane-1,3-dione Traditional Name: 1-(4-benzhydrylpiperazino)-4-(1H-benzimidazol-2-ylthio)butane-1,3-dione Formula: C28H28N4O2S MolecularWeight: 484.61252

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Descriptors Computed from Structure

Canonical SMILES:

C1CN(CCN1C(C2=CC=CC=C2)C3=CC=CC=C3)C(=O)CC(=O)CSC4=NC5=CC=CC=C5N4

Isomeric SMILES

C1CN(CCN1C(C2=CC=CC=C2)C3=CC=CC=C3)C(=O)CC(=O)CSC4=NC5=CC=CC=C5N4

InChI

InChI=1S/C28H28N4O2S/c33-23(20-35-28-29-24-13-7-8-14-25(24)30-28)19-26(34)31-15-17-32(18-16-31)27(21-9-3-1-4-10-21)22-11-5-2-6-12-22/h1-14,27H,15-20H2,(H,29,30)