1-[4-(3-bromophenyl)sulfonylpiperazin-1-yl]-3-methyl-but-2-en-1-one

Systemtic Name: 1-[4-(3-bromophenyl)sulfonylpiperazin-1-yl]-3-methyl-but-2-en-1-one Openeye Name: 1-[4-(3-bromophenyl)sulfonylpiperazin-1-yl]-3-methyl-but-2-en-1-one CAS Name: 1-[4-(3-bromophenyl)sulfonyl-1-piperazinyl]-3-methyl-2-buten-1-one IUPAC Name: 1-[4-(3-bromophenyl)sulfonylpiperazin-1-yl]-3-methylbut-2-en-1-one Traditional Name: 1-[4-(3-bromophenyl)sulfonylpiperazino]-3-methyl-but-2-en-1-one Formula: C15H19BrN2O3S MolecularWeight: 387.29196

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Descriptors Computed from Structure

Canonical SMILES:

CC(=CC(=O)N1CCN(CC1)S(=O)(=O)C2=CC(=CC=C2)Br)C

Isomeric SMILES

CC(=CC(=O)N1CCN(CC1)S(=O)(=O)C2=CC(=CC=C2)Br)C

InChI

InChI=1S/C15H19BrN2O3S/c1-12(2)10-15(19)17-6-8-18(9-7-17)22(20,21)14-5-3-4-13(16)11-14/h3-5,10-11H,6-9H2,1-2H3