[4-(4-bromanyl-3-methyl-phenyl)sulfonylpiperazin-1-yl]-[4-(5-methylpyrazol-1-yl)phenyl]methanone

Systemtic Name: [4-(4-bromanyl-3-methyl-phenyl)sulfonylpiperazin-1-yl]-[4-(5-methylpyrazol-1-yl)phenyl]methanone Openeye Name: [4-(4-bromo-3-methyl-phenyl)sulfonylpiperazin-1-yl]-[4-(5-methylpyrazol-1-yl)phenyl]methanone CAS Name: [4-(4-bromo-3-methylphenyl)sulfonyl-1-piperazinyl]-[4-(5-methyl-1-pyrazolyl)phenyl]methanone IUPAC Name: [4-(4-bromo-3-methylphenyl)sulfonylpiperazin-1-yl]-[4-(5-methylpyrazol-1-yl)phenyl]methanone Traditional Name: [4-(4-bromo-3-methyl-phenyl)sulfonylpiperazino]-[4-(5-methylpyrazol-1-yl)phenyl]methanone Formula: C22H23BrN4O3S MolecularWeight: 503.41202

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC=NN1C2=CC=C(C=C2)C(=O)N3CCN(CC3)S(=O)(=O)C4=CC(=C(C=C4)Br)C

Isomeric SMILES

CC1=CC=NN1C2=CC=C(C=C2)C(=O)N3CCN(CC3)S(=O)(=O)C4=CC(=C(C=C4)Br)C

InChI

InChI=1S/C22H23BrN4O3S/c1-16-15-20(7-8-21(16)23)31(29,30)26-13-11-25(12-14-26)22(28)18-3-5-19(6-4-18)27-17(2)9-10-24-27/h3-10,15H,11-14H2,1-2H3