1-(4-tert-butyl-2,6-dimethyl-phenyl)sulfonyl-4-(1-phenyl-1,2,3,4-tetrazol-5-yl)piperazine

Systemtic Name: 1-(4-tert-butyl-2,6-dimethyl-phenyl)sulfonyl-4-(1-phenyl-1,2,3,4-tetrazol-5-yl)piperazine Openeye Name: 1-(4-tert-butyl-2,6-dimethyl-phenyl)sulfonyl-4-(1-phenyltetrazol-5-yl)piperazine CAS Name: 1-(4-tert-butyl-2,6-dimethylphenyl)sulfonyl-4-(1-phenyl-5-tetrazolyl)piperazine IUPAC Name: 1-(4-tert-butyl-2,6-dimethylphenyl)sulfonyl-4-(1-phenyltetrazol-5-yl)piperazine Traditional Name: 1-(4-tert-butyl-2,6-dimethyl-phenyl)sulfonyl-4-(1-phenyltetrazol-5-yl)piperazine Formula: C23H30N6O2S MolecularWeight: 454.5883

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC(=CC(=C1S(=O)(=O)N2CCN(CC2)C3=NN=NN3C4=CC=CC=C4)C)C(C)(C)C

Isomeric SMILES

CC1=CC(=CC(=C1S(=O)(=O)N2CCN(CC2)C3=NN=NN3C4=CC=CC=C4)C)C(C)(C)C

InChI

InChI=1S/C23H30N6O2S/c1-17-15-19(23(3,4)5)16-18(2)21(17)32(30,31)28-13-11-27(12-14-28)22-24-25-26-29(22)20-9-7-6-8-10-20/h6-10,15-16H,11-14H2,1-5H3