(4-bromanyl-2-methylsulfonyl-phenyl)-(4-methylpiperazin-1-yl)methanone

Systemtic Name: (4-bromanyl-2-methylsulfonyl-phenyl)-(4-methylpiperazin-1-yl)methanone Openeye Name: (4-bromo-2-methylsulfonyl-phenyl)-(4-methylpiperazin-1-yl)methanone CAS Name: (4-bromo-2-methylsulfonylphenyl)-(4-methyl-1-piperazinyl)methanone IUPAC Name: (4-bromo-2-methylsulfonylphenyl)-(4-methylpiperazin-1-yl)methanone Traditional Name: (4-bromo-2-mesyl-phenyl)-(4-methylpiperazino)methanone Formula: C13H17BrN2O3S MolecularWeight: 361.25468

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Descriptors Computed from Structure

Canonical SMILES:

CN1CCN(CC1)C(=O)C2=C(C=C(C=C2)Br)S(=O)(=O)C

Isomeric SMILES

CN1CCN(CC1)C(=O)C2=C(C=C(C=C2)Br)S(=O)(=O)C

InChI

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