5-[4-(4-fluorophenyl)piperazin-1-yl]sulfonyl-N-(4-methoxyphenyl)-1H-pyrazole-3-carboxamide

Systemtic Name: 5-[4-(4-fluorophenyl)piperazin-1-yl]sulfonyl-N-(4-methoxyphenyl)-1H-pyrazole-3-carboxamide Openeye Name: 5-[4-(4-fluorophenyl)piperazin-1-yl]sulfonyl-N-(4-methoxyphenyl)-1H-pyrazole-3-carboxamide CAS Name: 5-[[4-(4-fluorophenyl)-1-piperazinyl]sulfonyl]-N-(4-methoxyphenyl)-1H-pyrazole-3-carboxamide IUPAC Name: 5-[4-(4-fluorophenyl)piperazin-1-yl]sulfonyl-N-(4-methoxyphenyl)-1H-pyrazole-3-carboxamide Traditional Name: 5-[4-(4-fluorophenyl)piperazino]sulfonyl-N-(4-methoxyphenyl)-1H-pyrazole-3-carboxamide Formula: C21H22FN5O4S MolecularWeight: 459.493883

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Descriptors Computed from Structure

Canonical SMILES:

COC1=CC=C(C=C1)NC(=O)C2=NNC(=C2)S(=O)(=O)N3CCN(CC3)C4=CC=C(C=C4)F

Isomeric SMILES

COC1=CC=C(C=C1)NC(=O)C2=NNC(=C2)S(=O)(=O)N3CCN(CC3)C4=CC=C(C=C4)F

InChI

InChI=1S/C21H22FN5O4S/c1-31-18-8-4-16(5-9-18)23-21(28)19-14-20(25-24-19)32(29,30)27-12-10-26(11-13-27)17-6-2-15(22)3-7-17/h2-9,14H,10-13H2,1H3,(H,23,28)(H,24,25)