[4-(4-bromophenyl)sulfonylpiperazin-1-yl]-[3-(4-ethoxyphenyl)-1H-pyrazol-5-yl]methanone

Systemtic Name: [4-(4-bromophenyl)sulfonylpiperazin-1-yl]-[3-(4-ethoxyphenyl)-1H-pyrazol-5-yl]methanone Openeye Name: [4-(4-bromophenyl)sulfonylpiperazin-1-yl]-[3-(4-ethoxyphenyl)-1H-pyrazol-5-yl]methanone CAS Name: [4-(4-bromophenyl)sulfonyl-1-piperazinyl]-[3-(4-ethoxyphenyl)-1H-pyrazol-5-yl]methanone IUPAC Name: [4-(4-bromophenyl)sulfonylpiperazin-1-yl]-[3-(4-ethoxyphenyl)-1H-pyrazol-5-yl]methanone Traditional Name: (4-brosylpiperazino)-(3-p-phenetyl-1H-pyrazol-5-yl)methanone Formula: C22H23BrN4O4S MolecularWeight: 519.41142

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Descriptors Computed from Structure

Canonical SMILES:

CCOC1=CC=C(C=C1)C2=NNC(=C2)C(=O)N3CCN(CC3)S(=O)(=O)C4=CC=C(C=C4)Br

Isomeric SMILES

CCOC1=CC=C(C=C1)C2=NNC(=C2)C(=O)N3CCN(CC3)S(=O)(=O)C4=CC=C(C=C4)Br

InChI

InChI=1S/C22H23BrN4O4S/c1-2-31-18-7-3-16(4-8-18)20-15-21(25-24-20)22(28)26-11-13-27(14-12-26)32(29,30)19-9-5-17(23)6-10-19/h3-10,15H,2,11-14H2,1H3,(H,24,25)