3-bromanyl-5-ethoxy-4-(3-phenylpropoxy)benzenecarbothioamide

Systemtic Name: 3-bromanyl-5-ethoxy-4-(3-phenylpropoxy)benzenecarbothioamide Openeye Name: 3-bromo-5-ethoxy-4-(3-phenylpropoxy)benzenecarbothioamide CAS Name: 3-bromo-5-ethoxy-4-(3-phenylpropoxy)benzenecarbothioamide IUPAC Name: 3-bromo-5-ethoxy-4-(3-phenylpropoxy)benzenecarbothioamide Traditional Name: 3-bromo-5-ethoxy-4-(3-phenylpropoxy)thiobenzamide Formula: C18H20BrNO2S MolecularWeight: 394.3259

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Descriptors Computed from Structure

Canonical SMILES:

CCOC1=C(C(=CC(=C1)C(=S)N)Br)OCCCC2=CC=CC=C2

Isomeric SMILES

CCOC1=C(C(=CC(=C1)C(=S)N)Br)OCCCC2=CC=CC=C2

InChI

InChI=1S/C18H20BrNO2S/c1-2-21-16-12-14(18(20)23)11-15(19)17(16)22-10-6-9-13-7-4-3-5-8-13/h3-5,7-8,11-12H,2,6,9-10H2,1H3,(H2,20,23)