1-[4-[(3-aminophenyl)methylsulfonyl]piperazin-1-yl]ethanone

Systemtic Name: 1-[4-[(3-aminophenyl)methylsulfonyl]piperazin-1-yl]ethanone Openeye Name: 1-[4-[(3-aminophenyl)methylsulfonyl]piperazin-1-yl]ethanone CAS Name: 1-[4-[(3-aminophenyl)methylsulfonyl]-1-piperazinyl]ethanone IUPAC Name: 1-[4-[(3-aminophenyl)methylsulfonyl]piperazin-1-yl]ethanone Traditional Name: 1-[4-(3-aminobenzyl)sulfonylpiperazino]ethanone Formula: C13H19N3O3S MolecularWeight: 297.37326

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Descriptors Computed from Structure

Canonical SMILES:

CC(=O)N1CCN(CC1)S(=O)(=O)CC2=CC(=CC=C2)N

Isomeric SMILES

CC(=O)N1CCN(CC1)S(=O)(=O)CC2=CC(=CC=C2)N

InChI

InChI=1S/C13H19N3O3S/c1-11(17)15-5-7-16(8-6-15)20(18,19)10-12-3-2-4-13(14)9-12/h2-4,9H,5-8,10,14H2,1H3