1-[4-(2,3-dimethylphenyl)piperazin-1-yl]-2-(4,5,6-trimethylpyrimidin-2-yl)sulfanyl-ethanone

Systemtic Name: 1-[4-(2,3-dimethylphenyl)piperazin-1-yl]-2-(4,5,6-trimethylpyrimidin-2-yl)sulfanyl-ethanone Openeye Name: 1-[4-(2,3-dimethylphenyl)piperazin-1-yl]-2-(4,5,6-trimethylpyrimidin-2-yl)sulfanyl-ethanone CAS Name: 1-[4-(2,3-dimethylphenyl)-1-piperazinyl]-2-[(4,5,6-trimethyl-2-pyrimidinyl)thio]ethanone IUPAC Name: 1-[4-(2,3-dimethylphenyl)piperazin-1-yl]-2-(4,5,6-trimethylpyrimidin-2-yl)sulfanylethanone Traditional Name: 1-[4-(2,3-dimethylphenyl)piperazino]-2-[(4,5,6-trimethylpyrimidin-2-yl)thio]ethanone Formula: C21H28N4OS MolecularWeight: 384.53822

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C(C(=CC=C1)N2CCN(CC2)C(=O)CSC3=NC(=C(C(=N3)C)C)C)C

Isomeric SMILES

CC1=C(C(=CC=C1)N2CCN(CC2)C(=O)CSC3=NC(=C(C(=N3)C)C)C)C

InChI

InChI=1S/C21H28N4OS/c1-14-7-6-8-19(15(14)2)24-9-11-25(12-10-24)20(26)13-27-21-22-17(4)16(3)18(5)23-21/h6-8H,9-13H2,1-5H3