2-[[4-(3-bromophenyl)sulfonylpiperazin-1-yl]methyl]-6-phenyl-pyridazin-3-one

Systemtic Name: 2-[[4-(3-bromophenyl)sulfonylpiperazin-1-yl]methyl]-6-phenyl-pyridazin-3-one Openeye Name: 2-[[4-(3-bromophenyl)sulfonylpiperazin-1-yl]methyl]-6-phenyl-pyridazin-3-one CAS Name: 2-[[4-(3-bromophenyl)sulfonyl-1-piperazinyl]methyl]-6-phenyl-3-pyridazinone IUPAC Name: 2-[[4-(3-bromophenyl)sulfonylpiperazin-1-yl]methyl]-6-phenylpyridazin-3-one Traditional Name: 2-[[4-(3-bromophenyl)sulfonylpiperazino]methyl]-6-phenyl-pyridazin-3-one Formula: C21H21BrN4O3S MolecularWeight: 489.38544

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Descriptors Computed from Structure

Canonical SMILES:

C1CN(CCN1CN2C(=O)C=CC(=N2)C3=CC=CC=C3)S(=O)(=O)C4=CC(=CC=C4)Br

Isomeric SMILES

C1CN(CCN1CN2C(=O)C=CC(=N2)C3=CC=CC=C3)S(=O)(=O)C4=CC(=CC=C4)Br

InChI

InChI=1S/C21H21BrN4O3S/c22-18-7-4-8-19(15-18)30(28,29)25-13-11-24(12-14-25)16-26-21(27)10-9-20(23-26)17-5-2-1-3-6-17/h1-10,15H,11-14,16H2