(2-methylsulfanylphenyl)-(4-pyrimidin-2-ylpiperazin-1-yl)methanone

Systemtic Name: (2-methylsulfanylphenyl)-(4-pyrimidin-2-ylpiperazin-1-yl)methanone Openeye Name: (2-methylsulfanylphenyl)-(4-pyrimidin-2-ylpiperazin-1-yl)methanone CAS Name: [2-(methylthio)phenyl]-[4-(2-pyrimidinyl)-1-piperazinyl]methanone IUPAC Name: (2-methylsulfanylphenyl)-(4-pyrimidin-2-ylpiperazin-1-yl)methanone Traditional Name: [2-(methylthio)phenyl]-[4-(2-pyrimidyl)piperazino]methanone Formula: C16H18N4OS MolecularWeight: 314.40532

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Descriptors Computed from Structure

Canonical SMILES:

CSC1=CC=CC=C1C(=O)N2CCN(CC2)C3=NC=CC=N3

Isomeric SMILES

CSC1=CC=CC=C1C(=O)N2CCN(CC2)C3=NC=CC=N3

InChI

InChI=1S/C16H18N4OS/c1-22-14-6-3-2-5-13(14)15(21)19-9-11-20(12-10-19)16-17-7-4-8-18-16/h2-8H,9-12H2,1H3