1-[4-(4-fluorophenyl)piperazin-1-yl]-2-[(5-methyl-4-nitro-1H-pyrazol-3-yl)sulfanyl]ethanone

Systemtic Name: 1-[4-(4-fluorophenyl)piperazin-1-yl]-2-[(5-methyl-4-nitro-1H-pyrazol-3-yl)sulfanyl]ethanone Openeye Name: 1-[4-(4-fluorophenyl)piperazin-1-yl]-2-[(5-methyl-4-nitro-1H-pyrazol-3-yl)sulfanyl]ethanone CAS Name: 1-[4-(4-fluorophenyl)-1-piperazinyl]-2-[(5-methyl-4-nitro-1H-pyrazol-3-yl)thio]ethanone IUPAC Name: 1-[4-(4-fluorophenyl)piperazin-1-yl]-2-[(5-methyl-4-nitro-1H-pyrazol-3-yl)sulfanyl]ethanone Traditional Name: 1-[4-(4-fluorophenyl)piperazino]-2-[(5-methyl-4-nitro-1H-pyrazol-3-yl)thio]ethanone Formula: C16H18FN5O3S MolecularWeight: 379.409223

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C(C(=NN1)SCC(=O)N2CCN(CC2)C3=CC=C(C=C3)F)[N+](=O)[O-]

Isomeric SMILES

CC1=C(C(=NN1)SCC(=O)N2CCN(CC2)C3=CC=C(C=C3)F)[N+](=O)[O-]

InChI

InChI=1S/C16H18FN5O3S/c1-11-15(22(24)25)16(19-18-11)26-10-14(23)21-8-6-20(7-9-21)13-4-2-12(17)3-5-13/h2-5H,6-10H2,1H3,(H,18,19)