(2-bromanyl-5-methoxy-phenyl)-(4-pyridin-3-ylsulfonylpiperazin-1-yl)methanone

Systemtic Name: (2-bromanyl-5-methoxy-phenyl)-(4-pyridin-3-ylsulfonylpiperazin-1-yl)methanone Openeye Name: (2-bromo-5-methoxy-phenyl)-[4-(3-pyridylsulfonyl)piperazin-1-yl]methanone CAS Name: (2-bromo-5-methoxyphenyl)-[4-(3-pyridinylsulfonyl)-1-piperazinyl]methanone IUPAC Name: (2-bromo-5-methoxyphenyl)-(4-pyridin-3-ylsulfonylpiperazin-1-yl)methanone Traditional Name: (2-bromo-5-methoxy-phenyl)-[4-(3-pyridylsulfonyl)piperazino]methanone Formula: C17H18BrN3O4S MolecularWeight: 440.31152

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C17H18BrN3O4S/c1-25-13-4-5-16(18)15(11-13)17(22)20-7-9-21(10-8-20)26(23,24)14-3-2-6-19-12-14/h2-6,11-12H,7-10H2,1H3