[4-[(4-bromanylpyrazol-1-yl)methyl]phenyl]-(4-ethylsulfonylpiperazin-1-yl)methanone

Systemtic Name: [4-[(4-bromanylpyrazol-1-yl)methyl]phenyl]-(4-ethylsulfonylpiperazin-1-yl)methanone Openeye Name: [4-[(4-bromopyrazol-1-yl)methyl]phenyl]-(4-ethylsulfonylpiperazin-1-yl)methanone CAS Name: [4-[(4-bromo-1-pyrazolyl)methyl]phenyl]-(4-ethylsulfonyl-1-piperazinyl)methanone IUPAC Name: [4-[(4-bromopyrazol-1-yl)methyl]phenyl]-(4-ethylsulfonylpiperazin-1-yl)methanone Traditional Name: [4-[(4-bromopyrazol-1-yl)methyl]phenyl]-(4-esylpiperazino)methanone Formula: C17H21BrN4O3S MolecularWeight: 441.34264

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Descriptors Computed from Structure

Canonical SMILES:

CCS(=O)(=O)N1CCN(CC1)C(=O)C2=CC=C(C=C2)CN3C=C(C=N3)Br

Isomeric SMILES

CCS(=O)(=O)N1CCN(CC1)C(=O)C2=CC=C(C=C2)CN3C=C(C=N3)Br

InChI

InChI=1S/C17H21BrN4O3S/c1-2-26(24,25)22-9-7-20(8-10-22)17(23)15-5-3-14(4-6-15)12-21-13-16(18)11-19-21/h3-6,11,13H,2,7-10,12H2,1H3