2-[ethyl-(phenylmethyl)amino]-1-[4-(phenylmethyl)sulfonylpiperazin-1-yl]ethanone

Systemtic Name: 2-[ethyl-(phenylmethyl)amino]-1-[4-(phenylmethyl)sulfonylpiperazin-1-yl]ethanone Openeye Name: 2-[benzyl(ethyl)amino]-1-(4-benzylsulfonylpiperazin-1-yl)ethanone CAS Name: 2-[ethyl-(phenylmethyl)amino]-1-[4-(phenylmethyl)sulfonyl-1-piperazinyl]ethanone IUPAC Name: 2-[benzyl(ethyl)amino]-1-(4-benzylsulfonylpiperazin-1-yl)ethanone Traditional Name: 2-[benzyl(ethyl)amino]-1-(4-benzylsulfonylpiperazino)ethanone Formula: C22H29N3O3S MolecularWeight: 415.54896

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Descriptors Computed from Structure

Canonical SMILES:

CCN(CC1=CC=CC=C1)CC(=O)N2CCN(CC2)S(=O)(=O)CC3=CC=CC=C3

Isomeric SMILES

CCN(CC1=CC=CC=C1)CC(=O)N2CCN(CC2)S(=O)(=O)CC3=CC=CC=C3

InChI

InChI=1S/C22H29N3O3S/c1-2-23(17-20-9-5-3-6-10-20)18-22(26)24-13-15-25(16-14-24)29(27,28)19-21-11-7-4-8-12-21/h3-12H,2,13-19H2,1H3