3-bromanyl-4-[2-(3,5-dimethylphenoxy)ethoxy]benzenecarbothioamide

Systemtic Name: 3-bromanyl-4-[2-(3,5-dimethylphenoxy)ethoxy]benzenecarbothioamide Openeye Name: 3-bromo-4-[2-(3,5-dimethylphenoxy)ethoxy]benzenecarbothioamide CAS Name: 3-bromo-4-[2-(3,5-dimethylphenoxy)ethoxy]benzenecarbothioamide IUPAC Name: 3-bromo-4-[2-(3,5-dimethylphenoxy)ethoxy]benzenecarbothioamide Traditional Name: 3-bromo-4-[2-(3,5-dimethylphenoxy)ethoxy]thiobenzamide Formula: C17H18BrNO2S MolecularWeight: 380.29932

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC(=CC(=C1)OCCOC2=C(C=C(C=C2)C(=S)N)Br)C

Isomeric SMILES

CC1=CC(=CC(=C1)OCCOC2=C(C=C(C=C2)C(=S)N)Br)C

InChI

InChI=1S/C17H18BrNO2S/c1-11-7-12(2)9-14(8-11)20-5-6-21-16-4-3-13(17(19)22)10-15(16)18/h3-4,7-10H,5-6H2,1-2H3,(H2,19,22)