1-(5-bromanylthiophen-2-yl)-3-[butyl(2-hydroxyethyl)amino]propan-1-one

Systemtic Name: 1-(5-bromanylthiophen-2-yl)-3-[butyl(2-hydroxyethyl)amino]propan-1-one Openeye Name: 1-(5-bromo-2-thienyl)-3-[butyl(2-hydroxyethyl)amino]propan-1-one CAS Name: 1-(5-bromo-2-thiophenyl)-3-[butyl(2-hydroxyethyl)amino]-1-propanone IUPAC Name: 1-(5-bromothiophen-2-yl)-3-[butyl(2-hydroxyethyl)amino]propan-1-one Traditional Name: 1-(5-bromo-2-thienyl)-3-[butyl(2-hydroxyethyl)amino]propan-1-one Formula: C13H20BrNO2S MolecularWeight: 334.2724

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Descriptors Computed from Structure

Canonical SMILES:

CCCCN(CCC(=O)C1=CC=C(S1)Br)CCO

Isomeric SMILES

CCCCN(CCC(=O)C1=CC=C(S1)Br)CCO

InChI

InChI=1S/C13H20BrNO2S/c1-2-3-7-15(9-10-16)8-6-11(17)12-4-5-13(14)18-12/h4-5,16H,2-3,6-10H2,1H3