1-[4-(5-bromanyl-2-methyl-phenyl)sulfonylpiperazin-1-yl]ethanone

Systemtic Name: 1-[4-(5-bromanyl-2-methyl-phenyl)sulfonylpiperazin-1-yl]ethanone Openeye Name: 1-[4-(5-bromo-2-methyl-phenyl)sulfonylpiperazin-1-yl]ethanone CAS Name: 1-[4-(5-bromo-2-methylphenyl)sulfonyl-1-piperazinyl]ethanone IUPAC Name: 1-[4-(5-bromo-2-methylphenyl)sulfonylpiperazin-1-yl]ethanone Traditional Name: 1-[4-(5-bromo-2-methyl-phenyl)sulfonylpiperazino]ethanone Formula: C13H17BrN2O3S MolecularWeight: 361.25468

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CC1=C(C=C(C=C1)Br)S(=O)(=O)N2CCN(CC2)C(=O)C

Isomeric SMILES

CC1=C(C=C(C=C1)Br)S(=O)(=O)N2CCN(CC2)C(=O)C

InChI

InChI=1S/C13H17BrN2O3S/c1-10-3-4-12(14)9-13(10)20(18,19)16-7-5-15(6-8-16)11(2)17/h3-4,9H,5-8H2,1-2H3