(3-bromanyl-2,5-dimethoxy-phenyl)-(4-thiophen-2-ylsulfonylpiperazin-1-yl)methanone

Systemtic Name: (3-bromanyl-2,5-dimethoxy-phenyl)-(4-thiophen-2-ylsulfonylpiperazin-1-yl)methanone Openeye Name: (3-bromo-2,5-dimethoxy-phenyl)-[4-(2-thienylsulfonyl)piperazin-1-yl]methanone CAS Name: (3-bromo-2,5-dimethoxyphenyl)-(4-thiophen-2-ylsulfonyl-1-piperazinyl)methanone IUPAC Name: (3-bromo-2,5-dimethoxyphenyl)-(4-thiophen-2-ylsulfonylpiperazin-1-yl)methanone Traditional Name: (3-bromo-2,5-dimethoxy-phenyl)-[4-(2-thienylsulfonyl)piperazino]methanone Formula: C17H19BrN2O5S2 MolecularWeight: 475.37716

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Descriptors Computed from Structure

Canonical SMILES:

COC1=CC(=C(C(=C1)C(=O)N2CCN(CC2)S(=O)(=O)C3=CC=CS3)OC)Br

Isomeric SMILES

COC1=CC(=C(C(=C1)C(=O)N2CCN(CC2)S(=O)(=O)C3=CC=CS3)OC)Br

InChI

InChI=1S/C17H19BrN2O5S2/c1-24-12-10-13(16(25-2)14(18)11-12)17(21)19-5-7-20(8-6-19)27(22,23)15-4-3-9-26-15/h3-4,9-11H,5-8H2,1-2H3