1-[4-(2-azanylethylsulfonyl)piperazin-1-yl]-2-ethyl-butan-1-one

Systemtic Name: 1-[4-(2-azanylethylsulfonyl)piperazin-1-yl]-2-ethyl-butan-1-one Openeye Name: 1-[4-(2-aminoethylsulfonyl)piperazin-1-yl]-2-ethyl-butan-1-one CAS Name: 1-[4-(2-aminoethylsulfonyl)-1-piperazinyl]-2-ethyl-1-butanone IUPAC Name: 1-[4-(2-aminoethylsulfonyl)piperazin-1-yl]-2-ethylbutan-1-one Traditional Name: 2-ethyl-1-(4-taurylpiperazino)butan-1-one Formula: C12H25N3O3S MolecularWeight: 291.4102

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Descriptors Computed from Structure

Canonical SMILES:

CCC(CC)C(=O)N1CCN(CC1)S(=O)(=O)CCN

Isomeric SMILES

CCC(CC)C(=O)N1CCN(CC1)S(=O)(=O)CCN

InChI

InChI=1S/C12H25N3O3S/c1-3-11(4-2)12(16)14-6-8-15(9-7-14)19(17,18)10-5-13/h11H,3-10,13H2,1-2H3