2-methylsulfanyl-N-[4-[2-oxidanylidene-2-(4-pyrimidin-2-ylpiperazin-1-yl)ethyl]phenyl]benzamide

Systemtic Name: 2-methylsulfanyl-N-[4-[2-oxidanylidene-2-(4-pyrimidin-2-ylpiperazin-1-yl)ethyl]phenyl]benzamide Openeye Name: 2-methylsulfanyl-N-[4-[2-oxo-2-(4-pyrimidin-2-ylpiperazin-1-yl)ethyl]phenyl]benzamide CAS Name: 2-(methylthio)-N-[4-[2-oxo-2-[4-(2-pyrimidinyl)-1-piperazinyl]ethyl]phenyl]benzamide IUPAC Name: 2-methylsulfanyl-N-[4-[2-oxo-2-(4-pyrimidin-2-ylpiperazin-1-yl)ethyl]phenyl]benzamide Traditional Name: N-[4-[2-keto-2-[4-(2-pyrimidyl)piperazino]ethyl]phenyl]-2-(methylthio)benzamide Formula: C24H25N5O2S MolecularWeight: 447.5526

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Descriptors Computed from Structure

Canonical SMILES:

CSC1=CC=CC=C1C(=O)NC2=CC=C(C=C2)CC(=O)N3CCN(CC3)C4=NC=CC=N4

Isomeric SMILES

CSC1=CC=CC=C1C(=O)NC2=CC=C(C=C2)CC(=O)N3CCN(CC3)C4=NC=CC=N4

InChI

InChI=1S/C24H25N5O2S/c1-32-21-6-3-2-5-20(21)23(31)27-19-9-7-18(8-10-19)17-22(30)28-13-15-29(16-14-28)24-25-11-4-12-26-24/h2-12H,13-17H2,1H3,(H,27,31)