1-[2,5-bis(chloranyl)phenyl]-4-(5-tert-butyl-2-methoxy-phenyl)sulfonyl-piperazine

Systemtic Name: 1-[2,5-bis(chloranyl)phenyl]-4-(5-tert-butyl-2-methoxy-phenyl)sulfonyl-piperazine Openeye Name: 1-(5-tert-butyl-2-methoxy-phenyl)sulfonyl-4-(2,5-dichlorophenyl)piperazine CAS Name: 1-(5-tert-butyl-2-methoxyphenyl)sulfonyl-4-(2,5-dichlorophenyl)piperazine IUPAC Name: 1-(5-tert-butyl-2-methoxyphenyl)sulfonyl-4-(2,5-dichlorophenyl)piperazine Traditional Name: 1-(5-tert-butyl-2-methoxy-phenyl)sulfonyl-4-(2,5-dichlorophenyl)piperazine Formula: C21H26Cl2N2O3S MolecularWeight: 457.41374

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)(C)C1=CC(=C(C=C1)OC)S(=O)(=O)N2CCN(CC2)C3=C(C=CC(=C3)Cl)Cl

Isomeric SMILES

CC(C)(C)C1=CC(=C(C=C1)OC)S(=O)(=O)N2CCN(CC2)C3=C(C=CC(=C3)Cl)Cl

InChI

InChI=1S/C21H26Cl2N2O3S/c1-21(2,3)15-5-8-19(28-4)20(13-15)29(26,27)25-11-9-24(10-12-25)18-14-16(22)6-7-17(18)23/h5-8,13-14H,9-12H2,1-4H3