(3,5-dimethyl-1-phenyl-pyrazol-4-yl)-[4-(2-methylsulfanylphenyl)piperazin-1-yl]methanone

Systemtic Name: (3,5-dimethyl-1-phenyl-pyrazol-4-yl)-[4-(2-methylsulfanylphenyl)piperazin-1-yl]methanone Openeye Name: (3,5-dimethyl-1-phenyl-pyrazol-4-yl)-[4-(2-methylsulfanylphenyl)piperazin-1-yl]methanone CAS Name: (3,5-dimethyl-1-phenyl-4-pyrazolyl)-[4-[2-(methylthio)phenyl]-1-piperazinyl]methanone IUPAC Name: (3,5-dimethyl-1-phenylpyrazol-4-yl)-[4-(2-methylsulfanylphenyl)piperazin-1-yl]methanone Traditional Name: (3,5-dimethyl-1-phenyl-pyrazol-4-yl)-[4-[2-(methylthio)phenyl]piperazino]methanone Formula: C23H26N4OS MolecularWeight: 406.54374

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C(C(=NN1C2=CC=CC=C2)C)C(=O)N3CCN(CC3)C4=CC=CC=C4SC

Isomeric SMILES

CC1=C(C(=NN1C2=CC=CC=C2)C)C(=O)N3CCN(CC3)C4=CC=CC=C4SC

InChI

InChI=1S/C23H26N4OS/c1-17-22(18(2)27(24-17)19-9-5-4-6-10-19)23(28)26-15-13-25(14-16-26)20-11-7-8-12-21(20)29-3/h4-12H,13-16H2,1-3H3