[3-(4-methoxyphenyl)-1H-pyrazol-5-yl]-[4-(phenylsulfonyl)piperazin-1-yl]methanone

Systemtic Name: [3-(4-methoxyphenyl)-1H-pyrazol-5-yl]-[4-(phenylsulfonyl)piperazin-1-yl]methanone Openeye Name: [4-(benzenesulfonyl)piperazin-1-yl]-[3-(4-methoxyphenyl)-1H-pyrazol-5-yl]methanone CAS Name: [4-(benzenesulfonyl)-1-piperazinyl]-[3-(4-methoxyphenyl)-1H-pyrazol-5-yl]methanone IUPAC Name: [4-(benzenesulfonyl)piperazin-1-yl]-[3-(4-methoxyphenyl)-1H-pyrazol-5-yl]methanone Traditional Name: (4-besylpiperazino)-[3-(4-methoxyphenyl)-1H-pyrazol-5-yl]methanone Formula: C21H22N4O4S MolecularWeight: 426.48878

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C21H22N4O4S/c1-29-17-9-7-16(8-10-17)19-15-20(23-22-19)21(26)24-11-13-25(14-12-24)30(27,28)18-5-3-2-4-6-18/h2-10,15H,11-14H2,1H3,(H,22,23)