1-[(4-tert-butylphenyl)methyl]-4-(4-iodophenyl)sulfonyl-piperazine

Systemtic Name: 1-[(4-tert-butylphenyl)methyl]-4-(4-iodophenyl)sulfonyl-piperazine Openeye Name: 1-[(4-tert-butylphenyl)methyl]-4-(4-iodophenyl)sulfonyl-piperazine CAS Name: 1-[(4-tert-butylphenyl)methyl]-4-(4-iodophenyl)sulfonylpiperazine IUPAC Name: 1-[(4-tert-butylphenyl)methyl]-4-(4-iodophenyl)sulfonylpiperazine Traditional Name: 1-(4-tert-butylbenzyl)-4-(4-iodophenyl)sulfonyl-piperazine Formula: C21H27IN2O2S MolecularWeight: 498.42075

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)(C)C1=CC=C(C=C1)CN2CCN(CC2)S(=O)(=O)C3=CC=C(C=C3)I

Isomeric SMILES

CC(C)(C)C1=CC=C(C=C1)CN2CCN(CC2)S(=O)(=O)C3=CC=C(C=C3)I

InChI

InChI=1S/C21H27IN2O2S/c1-21(2,3)18-6-4-17(5-7-18)16-23-12-14-24(15-13-23)27(25,26)20-10-8-19(22)9-11-20/h4-11H,12-16H2,1-3H3