4-(2-bromanyl-4,5-dimethoxy-phenyl)sulfonyl-N-cyclohexyl-piperazine-1-carboxamide

Systemtic Name: 4-(2-bromanyl-4,5-dimethoxy-phenyl)sulfonyl-N-cyclohexyl-piperazine-1-carboxamide Openeye Name: 4-(2-bromo-4,5-dimethoxy-phenyl)sulfonyl-N-cyclohexyl-piperazine-1-carboxamide CAS Name: 4-(2-bromo-4,5-dimethoxyphenyl)sulfonyl-N-cyclohexyl-1-piperazinecarboxamide IUPAC Name: 4-(2-bromo-4,5-dimethoxyphenyl)sulfonyl-N-cyclohexylpiperazine-1-carboxamide Traditional Name: 4-(2-bromo-4,5-dimethoxy-phenyl)sulfonyl-N-cyclohexyl-piperazine-1-carboxamide Formula: C19H28BrN3O5S MolecularWeight: 490.41172

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Descriptors Computed from Structure

Canonical SMILES:

COC1=CC(=C(C=C1OC)Br)S(=O)(=O)N2CCN(CC2)C(=O)NC3CCCCC3

Isomeric SMILES

COC1=CC(=C(C=C1OC)Br)S(=O)(=O)N2CCN(CC2)C(=O)NC3CCCCC3

InChI

InChI=1S/C19H28BrN3O5S/c1-27-16-12-15(20)18(13-17(16)28-2)29(25,26)23-10-8-22(9-11-23)19(24)21-14-6-4-3-5-7-14/h12-14H,3-11H2,1-2H3,(H,21,24)