5-bromanyl-2-(3-phenylpropoxy)benzenecarbothioamide

Systemtic Name: 5-bromanyl-2-(3-phenylpropoxy)benzenecarbothioamide Openeye Name: 5-bromo-2-(3-phenylpropoxy)benzenecarbothioamide CAS Name: 5-bromo-2-(3-phenylpropoxy)benzenecarbothioamide IUPAC Name: 5-bromo-2-(3-phenylpropoxy)benzenecarbothioamide Traditional Name: 5-bromo-2-(3-phenylpropoxy)thiobenzamide Formula: C16H16BrNOS MolecularWeight: 350.27334

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC=C(C=C1)CCCOC2=C(C=C(C=C2)Br)C(=S)N

Isomeric SMILES

C1=CC=C(C=C1)CCCOC2=C(C=C(C=C2)Br)C(=S)N

InChI

InChI=1S/C16H16BrNOS/c17-13-8-9-15(14(11-13)16(18)20)19-10-4-7-12-5-2-1-3-6-12/h1-3,5-6,8-9,11H,4,7,10H2,(H2,18,20)