3-bromanyl-5-ethoxy-4-pentoxy-benzenecarbothioamide

Systemtic Name: 3-bromanyl-5-ethoxy-4-pentoxy-benzenecarbothioamide Openeye Name: 3-bromo-5-ethoxy-4-pentoxy-benzenecarbothioamide CAS Name: 3-bromo-5-ethoxy-4-pentoxybenzenecarbothioamide IUPAC Name: 3-bromo-5-ethoxy-4-pentoxybenzenecarbothioamide Traditional Name: 4-amoxy-3-bromo-5-ethoxy-thiobenzamide Formula: C14H20BrNO2S MolecularWeight: 346.2831

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Descriptors Computed from Structure

Canonical SMILES:

CCCCCOC1=C(C=C(C=C1Br)C(=S)N)OCC

Isomeric SMILES

CCCCCOC1=C(C=C(C=C1Br)C(=S)N)OCC

InChI

InChI=1S/C14H20BrNO2S/c1-3-5-6-7-18-13-11(15)8-10(14(16)19)9-12(13)17-4-2/h8-9H,3-7H2,1-2H3,(H2,16,19)