N-[(5-bromanyl-2-propoxy-phenyl)methyl]-1-thiophen-2-yl-ethanamine

Systemtic Name: N-[(5-bromanyl-2-propoxy-phenyl)methyl]-1-thiophen-2-yl-ethanamine Openeye Name: N-[(5-bromo-2-propoxy-phenyl)methyl]-1-(2-thienyl)ethanamine CAS Name: N-[(5-bromo-2-propoxyphenyl)methyl]-1-thiophen-2-ylethanamine IUPAC Name: N-[(5-bromo-2-propoxyphenyl)methyl]-1-thiophen-2-ylethanamine Traditional Name: (5-bromo-2-propoxy-benzyl)-[1-(2-thienyl)ethyl]amine Formula: C16H20BrNOS MolecularWeight: 354.3051

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Descriptors Computed from Structure

Canonical SMILES:

CCCOC1=C(C=C(C=C1)Br)CNC(C)C2=CC=CS2

Isomeric SMILES

CCCOC1=C(C=C(C=C1)Br)CNC(C)C2=CC=CS2

InChI

InChI=1S/C16H20BrNOS/c1-3-8-19-15-7-6-14(17)10-13(15)11-18-12(2)16-5-4-9-20-16/h4-7,9-10,12,18H,3,8,11H2,1-2H3