(6R)-6-methyl-4-[(1-methylpyrazol-4-yl)methyl]-1-(2-methylsulfanylphenyl)piperazin-2-one

Systemtic Name: (6R)-6-methyl-4-[(1-methylpyrazol-4-yl)methyl]-1-(2-methylsulfanylphenyl)piperazin-2-one Openeye Name: (6R)-6-methyl-4-[(1-methylpyrazol-4-yl)methyl]-1-(2-methylsulfanylphenyl)piperazin-2-one CAS Name: (6R)-6-methyl-4-[(1-methyl-4-pyrazolyl)methyl]-1-[2-(methylthio)phenyl]-2-piperazinone IUPAC Name: (6R)-6-methyl-4-[(1-methylpyrazol-4-yl)methyl]-1-(2-methylsulfanylphenyl)piperazin-2-one Traditional Name: (6R)-6-methyl-4-[(1-methylpyrazol-4-yl)methyl]-1-[2-(methylthio)phenyl]piperazin-2-one Formula: C17H22N4OS MolecularWeight: 330.44778

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Descriptors Computed from Structure

Canonical SMILES:

CC1CN(CC(=O)N1C2=CC=CC=C2SC)CC3=CN(N=C3)C

Isomeric SMILES

C[C@@H]1CN(CC(=O)N1C2=CC=CC=C2SC)CC3=CN(N=C3)C

InChI

InChI=1S/C17H22N4OS/c1-13-9-20(11-14-8-18-19(2)10-14)12-17(22)21(13)15-6-4-5-7-16(15)23-3/h4-8,10,13H,9,11-12H2,1-3H3/t13-/m1/s1