2-[2-[4-(diphenylmethyl)piperazin-1-yl]-2-oxidanylidene-ethyl]sulfanyl-6-phenyl-1H-pyrimidin-4-one

Systemtic Name: 2-[2-[4-(diphenylmethyl)piperazin-1-yl]-2-oxidanylidene-ethyl]sulfanyl-6-phenyl-1H-pyrimidin-4-one Openeye Name: 2-[2-(4-benzhydrylpiperazin-1-yl)-2-oxo-ethyl]sulfanyl-6-phenyl-1H-pyrimidin-4-one CAS Name: 2-[[2-[4-(diphenylmethyl)-1-piperazinyl]-2-oxoethyl]thio]-6-phenyl-1H-pyrimidin-4-one IUPAC Name: 2-[2-(4-benzhydrylpiperazin-1-yl)-2-oxoethyl]sulfanyl-6-phenyl-1H-pyrimidin-4-one Traditional Name: 2-[[2-(4-benzhydrylpiperazino)-2-keto-ethyl]thio]-6-phenyl-1H-pyrimidin-4-one Formula: C29H28N4O2S MolecularWeight: 496.62322

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Descriptors Computed from Structure

Canonical SMILES:

C1CN(CCN1C(C2=CC=CC=C2)C3=CC=CC=C3)C(=O)CSC4=NC(=O)C=C(N4)C5=CC=CC=C5

Isomeric SMILES

C1CN(CCN1C(C2=CC=CC=C2)C3=CC=CC=C3)C(=O)CSC4=NC(=O)C=C(N4)C5=CC=CC=C5

InChI

InChI=1S/C29H28N4O2S/c34-26-20-25(22-10-4-1-5-11-22)30-29(31-26)36-21-27(35)32-16-18-33(19-17-32)28(23-12-6-2-7-13-23)24-14-8-3-9-15-24/h1-15,20,28H,16-19,21H2,(H,30,31,34)