6-[2-oxidanylidene-2-[4-(phenylmethyl)piperazin-1-yl]ethyl]-2-(phenylmethylsulfanyl)-1H-pyrimidin-4-one

Systemtic Name: 6-[2-oxidanylidene-2-[4-(phenylmethyl)piperazin-1-yl]ethyl]-2-(phenylmethylsulfanyl)-1H-pyrimidin-4-one Openeye Name: 6-[2-(4-benzylpiperazin-1-yl)-2-oxo-ethyl]-2-benzylsulfanyl-1H-pyrimidin-4-one CAS Name: 6-[2-oxo-2-[4-(phenylmethyl)-1-piperazinyl]ethyl]-2-(phenylmethylthio)-1H-pyrimidin-4-one IUPAC Name: 6-[2-(4-benzylpiperazin-1-yl)-2-oxoethyl]-2-benzylsulfanyl-1H-pyrimidin-4-one Traditional Name: 6-[2-(4-benzylpiperazino)-2-keto-ethyl]-2-(benzylthio)-1H-pyrimidin-4-one Formula: C24H26N4O2S MolecularWeight: 434.55384

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Descriptors Computed from Structure

Canonical SMILES:

C1CN(CCN1CC2=CC=CC=C2)C(=O)CC3=CC(=O)N=C(N3)SCC4=CC=CC=C4

Isomeric SMILES

C1CN(CCN1CC2=CC=CC=C2)C(=O)CC3=CC(=O)N=C(N3)SCC4=CC=CC=C4

InChI

InChI=1S/C24H26N4O2S/c29-22-15-21(25-24(26-22)31-18-20-9-5-2-6-10-20)16-23(30)28-13-11-27(12-14-28)17-19-7-3-1-4-8-19/h1-10,15H,11-14,16-18H2,(H,25,26,29)