8-bromanyl-N-(2-methylsulfanylphenyl)-2,3,4,5-tetrahydro-1-benzoxepin-5-amine

Systemtic Name: 8-bromanyl-N-(2-methylsulfanylphenyl)-2,3,4,5-tetrahydro-1-benzoxepin-5-amine Openeye Name: 8-bromo-N-(2-methylsulfanylphenyl)-2,3,4,5-tetrahydro-1-benzoxepin-5-amine CAS Name: 8-bromo-N-[2-(methylthio)phenyl]-2,3,4,5-tetrahydro-1-benzoxepin-5-amine IUPAC Name: 8-bromo-N-(2-methylsulfanylphenyl)-2,3,4,5-tetrahydro-1-benzoxepin-5-amine Traditional Name: (8-bromo-2,3,4,5-tetrahydro-1-benzoxepin-5-yl)-[2-(methylthio)phenyl]amine Formula: C17H18BrNOS MolecularWeight: 364.29992

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Descriptors Computed from Structure

Canonical SMILES:

CSC1=CC=CC=C1NC2CCCOC3=C2C=CC(=C3)Br

Isomeric SMILES

CSC1=CC=CC=C1NC2CCCOC3=C2C=CC(=C3)Br

InChI

InChI=1S/C17H18BrNOS/c1-21-17-7-3-2-5-15(17)19-14-6-4-10-20-16-11-12(18)8-9-13(14)16/h2-3,5,7-9,11,14,19H,4,6,10H2,1H3