2-(3,5-dimethyl-1-phenyl-pyrazol-4-yl)sulfanyl-1-(4-phenylpiperazin-1-yl)ethanone

Systemtic Name: 2-(3,5-dimethyl-1-phenyl-pyrazol-4-yl)sulfanyl-1-(4-phenylpiperazin-1-yl)ethanone Openeye Name: 2-(3,5-dimethyl-1-phenyl-pyrazol-4-yl)sulfanyl-1-(4-phenylpiperazin-1-yl)ethanone CAS Name: 2-[(3,5-dimethyl-1-phenyl-4-pyrazolyl)thio]-1-(4-phenyl-1-piperazinyl)ethanone IUPAC Name: 2-(3,5-dimethyl-1-phenylpyrazol-4-yl)sulfanyl-1-(4-phenylpiperazin-1-yl)ethanone Traditional Name: 2-[(3,5-dimethyl-1-phenyl-pyrazol-4-yl)thio]-1-(4-phenylpiperazino)ethanone Formula: C23H26N4OS MolecularWeight: 406.54374

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C23H26N4OS/c1-18-23(19(2)27(24-18)21-11-7-4-8-12-21)29-17-22(28)26-15-13-25(14-16-26)20-9-5-3-6-10-20/h3-12H,13-17H2,1-2H3