N-[2-(4-fluorophenyl)-5-methyl-pyrazol-3-yl]-2-(4-thiophen-2-ylsulfonylpiperazin-1-yl)ethanamide

Systemtic Name: N-[2-(4-fluorophenyl)-5-methyl-pyrazol-3-yl]-2-(4-thiophen-2-ylsulfonylpiperazin-1-yl)ethanamide Openeye Name: N-[2-(4-fluorophenyl)-5-methyl-pyrazol-3-yl]-2-[4-(2-thienylsulfonyl)piperazin-1-yl]acetamide CAS Name: N-[2-(4-fluorophenyl)-5-methyl-3-pyrazolyl]-2-(4-thiophen-2-ylsulfonyl-1-piperazinyl)acetamide IUPAC Name: N-[2-(4-fluorophenyl)-5-methylpyrazol-3-yl]-2-(4-thiophen-2-ylsulfonylpiperazin-1-yl)acetamide Traditional Name: N-[2-(4-fluorophenyl)-5-methyl-pyrazol-3-yl]-2-[4-(2-thienylsulfonyl)piperazino]acetamide Formula: C20H22FN5O3S2 MolecularWeight: 463.548783

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Descriptors Computed from Structure

Canonical SMILES:

CC1=NN(C(=C1)NC(=O)CN2CCN(CC2)S(=O)(=O)C3=CC=CS3)C4=CC=C(C=C4)F

Isomeric SMILES

CC1=NN(C(=C1)NC(=O)CN2CCN(CC2)S(=O)(=O)C3=CC=CS3)C4=CC=C(C=C4)F

InChI

InChI=1S/C20H22FN5O3S2/c1-15-13-18(26(23-15)17-6-4-16(21)5-7-17)22-19(27)14-24-8-10-25(11-9-24)31(28,29)20-3-2-12-30-20/h2-7,12-13H,8-11,14H2,1H3,(H,22,27)