5-bromanyl-3-methoxy-2-phenethyloxy-benzenecarbothioamide

Systemtic Name: 5-bromanyl-3-methoxy-2-phenethyloxy-benzenecarbothioamide Openeye Name: 5-bromo-3-methoxy-2-phenethyloxy-benzenecarbothioamide CAS Name: 5-bromo-3-methoxy-2-phenethyloxybenzenecarbothioamide IUPAC Name: 5-bromo-3-methoxy-2-phenethyloxybenzenecarbothioamide Traditional Name: 5-bromo-3-methoxy-2-phenethyloxy-thiobenzamide Formula: C16H16BrNO2S MolecularWeight: 366.27274

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Descriptors Computed from Structure

Canonical SMILES:

COC1=C(C(=CC(=C1)Br)C(=S)N)OCCC2=CC=CC=C2

Isomeric SMILES

COC1=C(C(=CC(=C1)Br)C(=S)N)OCCC2=CC=CC=C2

InChI

InChI=1S/C16H16BrNO2S/c1-19-14-10-12(17)9-13(16(18)21)15(14)20-8-7-11-5-3-2-4-6-11/h2-6,9-10H,7-8H2,1H3,(H2,18,21)