(5-chloranyl-2-methylsulfanyl-pyrimidin-4-yl)-(4-pyrimidin-2-ylpiperazin-1-yl)methanone

Systemtic Name: (5-chloranyl-2-methylsulfanyl-pyrimidin-4-yl)-(4-pyrimidin-2-ylpiperazin-1-yl)methanone Openeye Name: (5-chloro-2-methylsulfanyl-pyrimidin-4-yl)-(4-pyrimidin-2-ylpiperazin-1-yl)methanone CAS Name: [5-chloro-2-(methylthio)-4-pyrimidinyl]-[4-(2-pyrimidinyl)-1-piperazinyl]methanone IUPAC Name: (5-chloro-2-methylsulfanylpyrimidin-4-yl)-(4-pyrimidin-2-ylpiperazin-1-yl)methanone Traditional Name: [5-chloro-2-(methylthio)pyrimidin-4-yl]-[4-(2-pyrimidyl)piperazino]methanone Formula: C14H15ClN6OS MolecularWeight: 350.8265

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Descriptors Computed from Structure

Canonical SMILES:

CSC1=NC=C(C(=N1)C(=O)N2CCN(CC2)C3=NC=CC=N3)Cl

Isomeric SMILES

CSC1=NC=C(C(=N1)C(=O)N2CCN(CC2)C3=NC=CC=N3)Cl

InChI

InChI=1S/C14H15ClN6OS/c1-23-14-18-9-10(15)11(19-14)12(22)20-5-7-21(8-6-20)13-16-3-2-4-17-13/h2-4,9H,5-8H2,1H3