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

Systemtic Name: 1-(4-cyclopropylcarbonylpiperazin-1-yl)-2-(3,5-dimethyl-1-phenyl-pyrazol-4-yl)sulfanyl-ethanone Openeye Name: 1-[4-(cyclopropanecarbonyl)piperazin-1-yl]-2-(3,5-dimethyl-1-phenyl-pyrazol-4-yl)sulfanyl-ethanone CAS Name: 1-[4-[cyclopropyl(oxo)methyl]-1-piperazinyl]-2-[(3,5-dimethyl-1-phenyl-4-pyrazolyl)thio]ethanone IUPAC Name: 1-[4-(cyclopropanecarbonyl)piperazin-1-yl]-2-(3,5-dimethyl-1-phenylpyrazol-4-yl)sulfanylethanone Traditional Name: 1-[4-(cyclopropanecarbonyl)piperazino]-2-[(3,5-dimethyl-1-phenyl-pyrazol-4-yl)thio]ethanone Formula: C21H26N4O2S MolecularWeight: 398.52174

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CC1=C(C(=NN1C2=CC=CC=C2)C)SCC(=O)N3CCN(CC3)C(=O)C4CC4

Isomeric SMILES

CC1=C(C(=NN1C2=CC=CC=C2)C)SCC(=O)N3CCN(CC3)C(=O)C4CC4

InChI

InChI=1S/C21H26N4O2S/c1-15-20(16(2)25(22-15)18-6-4-3-5-7-18)28-14-19(26)23-10-12-24(13-11-23)21(27)17-8-9-17/h3-7,17H,8-14H2,1-2H3