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

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

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Descriptors Computed from Structure

Canonical SMILES:

CSC1=CC=C(C=C1)C(=O)N2CCN(CC2)C3=NC=CC=N3

Isomeric SMILES

CSC1=CC=C(C=C1)C(=O)N2CCN(CC2)C3=NC=CC=N3

InChI

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