1-ethyl-4-[[1-[(4-methylphenyl)sulfonylmethyl]-1,2,3,4-tetrazol-5-yl]-phenyl-methyl]piperazine

Systemtic Name: 1-ethyl-4-[[1-[(4-methylphenyl)sulfonylmethyl]-1,2,3,4-tetrazol-5-yl]-phenyl-methyl]piperazine Openeye Name: 1-ethyl-4-[phenyl-[1-(p-tolylsulfonylmethyl)tetrazol-5-yl]methyl]piperazine CAS Name: 1-ethyl-4-[[1-[(4-methylphenyl)sulfonylmethyl]-5-tetrazolyl]-phenylmethyl]piperazine IUPAC Name: 1-ethyl-4-[[1-[(4-methylphenyl)sulfonylmethyl]tetrazol-5-yl]-phenylmethyl]piperazine Traditional Name: 1-ethyl-4-[phenyl-[1-(tosylmethyl)tetrazol-5-yl]methyl]piperazine Formula: C22H28N6O2S MolecularWeight: 440.56172

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Descriptors Computed from Structure

Canonical SMILES:

CCN1CCN(CC1)C(C2=CC=CC=C2)C3=NN=NN3CS(=O)(=O)C4=CC=C(C=C4)C

Isomeric SMILES

CCN1CCN(CC1)C(C2=CC=CC=C2)C3=NN=NN3CS(=O)(=O)C4=CC=C(C=C4)C

InChI

InChI=1S/C22H28N6O2S/c1-3-26-13-15-27(16-14-26)21(19-7-5-4-6-8-19)22-23-24-25-28(22)17-31(29,30)20-11-9-18(2)10-12-20/h4-12,21H,3,13-17H2,1-2H3