1-(1-phenyl-1,2,3,4-tetrazol-5-yl)-4-(4-propan-2-ylphenyl)sulfonyl-piperazine

Systemtic Name: 1-(1-phenyl-1,2,3,4-tetrazol-5-yl)-4-(4-propan-2-ylphenyl)sulfonyl-piperazine Openeye Name: 1-(4-isopropylphenyl)sulfonyl-4-(1-phenyltetrazol-5-yl)piperazine CAS Name: 1-(1-phenyl-5-tetrazolyl)-4-(4-propan-2-ylphenyl)sulfonylpiperazine IUPAC Name: 1-(1-phenyltetrazol-5-yl)-4-(4-propan-2-ylphenyl)sulfonylpiperazine Traditional Name: 1-p-cumenylsulfonyl-4-(1-phenyltetrazol-5-yl)piperazine Formula: C20H24N6O2S MolecularWeight: 412.50856

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

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