2-[4-(3-bromanyl-4-methoxy-phenyl)sulfonylpiperazin-1-yl]-N-(2-methylpropyl)ethanamide

Systemtic Name: 2-[4-(3-bromanyl-4-methoxy-phenyl)sulfonylpiperazin-1-yl]-N-(2-methylpropyl)ethanamide Openeye Name: 2-[4-(3-bromo-4-methoxy-phenyl)sulfonylpiperazin-1-yl]-N-isobutyl-acetamide CAS Name: 2-[4-(3-bromo-4-methoxyphenyl)sulfonyl-1-piperazinyl]-N-(2-methylpropyl)acetamide IUPAC Name: 2-[4-(3-bromo-4-methoxyphenyl)sulfonylpiperazin-1-yl]-N-(2-methylpropyl)acetamide Traditional Name: 2-[4-(3-bromo-4-methoxy-phenyl)sulfonylpiperazino]-N-isobutyl-acetamide Formula: C17H26BrN3O4S MolecularWeight: 448.37504

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)CNC(=O)CN1CCN(CC1)S(=O)(=O)C2=CC(=C(C=C2)OC)Br

Isomeric SMILES

CC(C)CNC(=O)CN1CCN(CC1)S(=O)(=O)C2=CC(=C(C=C2)OC)Br

InChI

InChI=1S/C17H26BrN3O4S/c1-13(2)11-19-17(22)12-20-6-8-21(9-7-20)26(23,24)14-4-5-16(25-3)15(18)10-14/h4-5,10,13H,6-9,11-12H2,1-3H3,(H,19,22)