3-bromanyl-4-methoxy-N-[2-(phenylmethylsulfanyl)ethyl]benzamide

Systemtic Name: 3-bromanyl-4-methoxy-N-[2-(phenylmethylsulfanyl)ethyl]benzamide Openeye Name: N-(2-benzylsulfanylethyl)-3-bromo-4-methoxy-benzamide CAS Name: 3-bromo-4-methoxy-N-[2-(phenylmethylthio)ethyl]benzamide IUPAC Name: N-(2-benzylsulfanylethyl)-3-bromo-4-methoxybenzamide Traditional Name: N-[2-(benzylthio)ethyl]-3-bromo-4-methoxy-benzamide Formula: C17H18BrNO2S MolecularWeight: 380.29932

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Descriptors Computed from Structure

Canonical SMILES:

COC1=C(C=C(C=C1)C(=O)NCCSCC2=CC=CC=C2)Br

Isomeric SMILES

COC1=C(C=C(C=C1)C(=O)NCCSCC2=CC=CC=C2)Br

InChI

InChI=1S/C17H18BrNO2S/c1-21-16-8-7-14(11-15(16)18)17(20)19-9-10-22-12-13-5-3-2-4-6-13/h2-8,11H,9-10,12H2,1H3,(H,19,20)