[4-[2,5-bis(bromanyl)phenyl]sulfonylpiperazin-1-yl]-(4-pyrazol-1-ylphenyl)methanone

Systemtic Name: [4-[2,5-bis(bromanyl)phenyl]sulfonylpiperazin-1-yl]-(4-pyrazol-1-ylphenyl)methanone Openeye Name: [4-(2,5-dibromophenyl)sulfonylpiperazin-1-yl]-(4-pyrazol-1-ylphenyl)methanone CAS Name: [4-(2,5-dibromophenyl)sulfonyl-1-piperazinyl]-[4-(1-pyrazolyl)phenyl]methanone IUPAC Name: [4-(2,5-dibromophenyl)sulfonylpiperazin-1-yl]-(4-pyrazol-1-ylphenyl)methanone Traditional Name: [4-(2,5-dibromophenyl)sulfonylpiperazino]-(4-pyrazol-1-ylphenyl)methanone Formula: C20H18Br2N4O3S MolecularWeight: 554.25492

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Descriptors Computed from Structure

Canonical SMILES:

C1CN(CCN1C(=O)C2=CC=C(C=C2)N3C=CC=N3)S(=O)(=O)C4=C(C=CC(=C4)Br)Br

Isomeric SMILES

C1CN(CCN1C(=O)C2=CC=C(C=C2)N3C=CC=N3)S(=O)(=O)C4=C(C=CC(=C4)Br)Br

InChI

InChI=1S/C20H18Br2N4O3S/c21-16-4-7-18(22)19(14-16)30(28,29)25-12-10-24(11-13-25)20(27)15-2-5-17(6-3-15)26-9-1-8-23-26/h1-9,14H,10-13H2