1-(4-bromanyl-2-ethyl-phenyl)sulfonyl-4-(2-ethoxyphenyl)piperazine

Systemtic Name: 1-(4-bromanyl-2-ethyl-phenyl)sulfonyl-4-(2-ethoxyphenyl)piperazine Openeye Name: 1-(4-bromo-2-ethyl-phenyl)sulfonyl-4-(2-ethoxyphenyl)piperazine CAS Name: 1-(4-bromo-2-ethylphenyl)sulfonyl-4-(2-ethoxyphenyl)piperazine IUPAC Name: 1-(4-bromo-2-ethylphenyl)sulfonyl-4-(2-ethoxyphenyl)piperazine Traditional Name: 1-(4-bromo-2-ethyl-phenyl)sulfonyl-4-o-phenetyl-piperazine Formula: C20H25BrN2O3S MolecularWeight: 453.3931

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Descriptors Computed from Structure

Canonical SMILES:

CCC1=C(C=CC(=C1)Br)S(=O)(=O)N2CCN(CC2)C3=CC=CC=C3OCC

Isomeric SMILES

CCC1=C(C=CC(=C1)Br)S(=O)(=O)N2CCN(CC2)C3=CC=CC=C3OCC

InChI

InChI=1S/C20H25BrN2O3S/c1-3-16-15-17(21)9-10-20(16)27(24,25)23-13-11-22(12-14-23)18-7-5-6-8-19(18)26-4-2/h5-10,15H,3-4,11-14H2,1-2H3