1-[4-(3-chlorophenyl)piperazin-1-yl]-2-(2,6-dimethylpyrimidin-4-yl)sulfanyl-ethanone

Systemtic Name: 1-[4-(3-chlorophenyl)piperazin-1-yl]-2-(2,6-dimethylpyrimidin-4-yl)sulfanyl-ethanone Openeye Name: 1-[4-(3-chlorophenyl)piperazin-1-yl]-2-(2,6-dimethylpyrimidin-4-yl)sulfanyl-ethanone CAS Name: 1-[4-(3-chlorophenyl)-1-piperazinyl]-2-[(2,6-dimethyl-4-pyrimidinyl)thio]ethanone IUPAC Name: 1-[4-(3-chlorophenyl)piperazin-1-yl]-2-(2,6-dimethylpyrimidin-4-yl)sulfanylethanone Traditional Name: 1-[4-(3-chlorophenyl)piperazino]-2-[(2,6-dimethylpyrimidin-4-yl)thio]ethanone Formula: C18H21ClN4OS MolecularWeight: 376.90354

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC(=NC(=N1)C)SCC(=O)N2CCN(CC2)C3=CC(=CC=C3)Cl

Isomeric SMILES

CC1=CC(=NC(=N1)C)SCC(=O)N2CCN(CC2)C3=CC(=CC=C3)Cl

InChI

InChI=1S/C18H21ClN4OS/c1-13-10-17(21-14(2)20-13)25-12-18(24)23-8-6-22(7-9-23)16-5-3-4-15(19)11-16/h3-5,10-11H,6-9,12H2,1-2H3