1-(1-phenyl-1,2,3,4-tetrazol-5-yl)-4-(2,4,6-trimethylphenyl)sulfonyl-piperazine

Systemtic Name: 1-(1-phenyl-1,2,3,4-tetrazol-5-yl)-4-(2,4,6-trimethylphenyl)sulfonyl-piperazine Openeye Name: 1-(1-phenyltetrazol-5-yl)-4-(2,4,6-trimethylphenyl)sulfonyl-piperazine CAS Name: 1-(1-phenyl-5-tetrazolyl)-4-(2,4,6-trimethylphenyl)sulfonylpiperazine IUPAC Name: 1-(1-phenyltetrazol-5-yl)-4-(2,4,6-trimethylphenyl)sulfonylpiperazine Traditional Name: 1-mesitylsulfonyl-4-(1-phenyltetrazol-5-yl)piperazine Formula: C20H24N6O2S MolecularWeight: 412.50856

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC(=C(C(=C1)C)S(=O)(=O)N2CCN(CC2)C3=NN=NN3C4=CC=CC=C4)C

Isomeric SMILES

CC1=CC(=C(C(=C1)C)S(=O)(=O)N2CCN(CC2)C3=NN=NN3C4=CC=CC=C4)C

InChI

InChI=1S/C20H24N6O2S/c1-15-13-16(2)19(17(3)14-15)29(27,28)25-11-9-24(10-12-25)20-21-22-23-26(20)18-7-5-4-6-8-18/h4-8,13-14H,9-12H2,1-3H3