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

Systemtic Name: 1-[3-methyl-1-[1-[(4-methylphenyl)sulfonylmethyl]-1,2,3,4-tetrazol-5-yl]butyl]-4-(phenylmethyl)piperazine Openeye Name: 1-benzyl-4-[3-methyl-1-[1-(p-tolylsulfonylmethyl)tetrazol-5-yl]butyl]piperazine CAS Name: 1-[3-methyl-1-[1-[(4-methylphenyl)sulfonylmethyl]-5-tetrazolyl]butyl]-4-(phenylmethyl)piperazine IUPAC Name: 1-benzyl-4-[3-methyl-1-[1-[(4-methylphenyl)sulfonylmethyl]tetrazol-5-yl]butyl]piperazine Traditional Name: 1-benzyl-4-[3-methyl-1-[1-(tosylmethyl)tetrazol-5-yl]butyl]piperazine Formula: C25H34N6O2S MolecularWeight: 482.64146

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC=C(C=C1)S(=O)(=O)CN2C(=NN=N2)C(CC(C)C)N3CCN(CC3)CC4=CC=CC=C4

Isomeric SMILES

CC1=CC=C(C=C1)S(=O)(=O)CN2C(=NN=N2)C(CC(C)C)N3CCN(CC3)CC4=CC=CC=C4

InChI

InChI=1S/C25H34N6O2S/c1-20(2)17-24(30-15-13-29(14-16-30)18-22-7-5-4-6-8-22)25-26-27-28-31(25)19-34(32,33)23-11-9-21(3)10-12-23/h4-12,20,24H,13-19H2,1-3H3