5-bromanyl-2-pentoxy-benzenecarbothioamide

Systemtic Name: 5-bromanyl-2-pentoxy-benzenecarbothioamide Openeye Name: 5-bromo-2-pentoxy-benzenecarbothioamide CAS Name: 5-bromo-2-pentoxybenzenecarbothioamide IUPAC Name: 5-bromo-2-pentoxybenzenecarbothioamide Traditional Name: 2-amoxy-5-bromo-thiobenzamide Formula: C12H16BrNOS MolecularWeight: 302.23054

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Descriptors Computed from Structure

Canonical SMILES:

CCCCCOC1=C(C=C(C=C1)Br)C(=S)N

Isomeric SMILES

CCCCCOC1=C(C=C(C=C1)Br)C(=S)N

InChI

InChI=1S/C12H16BrNOS/c1-2-3-4-7-15-11-6-5-9(13)8-10(11)12(14)16/h5-6,8H,2-4,7H2,1H3,(H2,14,16)