1-(2,4-dimethylphenyl)sulfonyl-4-[(1-phenyl-1,2,3,4-tetrazol-5-yl)methyl]piperazine

Systemtic Name: 1-(2,4-dimethylphenyl)sulfonyl-4-[(1-phenyl-1,2,3,4-tetrazol-5-yl)methyl]piperazine Openeye Name: 1-(2,4-dimethylphenyl)sulfonyl-4-[(1-phenyltetrazol-5-yl)methyl]piperazine CAS Name: 1-(2,4-dimethylphenyl)sulfonyl-4-[(1-phenyl-5-tetrazolyl)methyl]piperazine IUPAC Name: 1-(2,4-dimethylphenyl)sulfonyl-4-[(1-phenyltetrazol-5-yl)methyl]piperazine Traditional Name: 1-(2,4-dimethylphenyl)sulfonyl-4-[(1-phenyltetrazol-5-yl)methyl]piperazine Formula: C20H24N6O2S MolecularWeight: 412.50856

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC(=C(C=C1)S(=O)(=O)N2CCN(CC2)CC3=NN=NN3C4=CC=CC=C4)C

Isomeric SMILES

CC1=CC(=C(C=C1)S(=O)(=O)N2CCN(CC2)CC3=NN=NN3C4=CC=CC=C4)C

InChI

InChI=1S/C20H24N6O2S/c1-16-8-9-19(17(2)14-16)29(27,28)25-12-10-24(11-13-25)15-20-21-22-23-26(20)18-6-4-3-5-7-18/h3-9,14H,10-13,15H2,1-2H3