6-[[4-(3-bromophenyl)sulfonylpiperazin-1-yl]methyl]-1,3-dimethyl-pyrimidine-2,4-dione

Systemtic Name: 6-[[4-(3-bromophenyl)sulfonylpiperazin-1-yl]methyl]-1,3-dimethyl-pyrimidine-2,4-dione Openeye Name: 6-[[4-(3-bromophenyl)sulfonylpiperazin-1-yl]methyl]-1,3-dimethyl-pyrimidine-2,4-dione CAS Name: 6-[[4-(3-bromophenyl)sulfonyl-1-piperazinyl]methyl]-1,3-dimethylpyrimidine-2,4-dione IUPAC Name: 6-[[4-(3-bromophenyl)sulfonylpiperazin-1-yl]methyl]-1,3-dimethylpyrimidine-2,4-dione Traditional Name: 6-[[4-(3-bromophenyl)sulfonylpiperazino]methyl]-1,3-dimethyl-pyrimidine-2,4-quinone Formula: C17H21BrN4O4S MolecularWeight: 457.34204

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Descriptors Computed from Structure

Canonical SMILES:

CN1C(=CC(=O)N(C1=O)C)CN2CCN(CC2)S(=O)(=O)C3=CC(=CC=C3)Br

Isomeric SMILES

CN1C(=CC(=O)N(C1=O)C)CN2CCN(CC2)S(=O)(=O)C3=CC(=CC=C3)Br

InChI

InChI=1S/C17H21BrN4O4S/c1-19-14(11-16(23)20(2)17(19)24)12-21-6-8-22(9-7-21)27(25,26)15-5-3-4-13(18)10-15/h3-5,10-11H,6-9,12H2,1-2H3