3-bromanyl-4-ethoxy-N-(3-oxidanylpropylcarbamothioyl)benzamide

Systemtic Name: 3-bromanyl-4-ethoxy-N-(3-oxidanylpropylcarbamothioyl)benzamide Openeye Name: 3-bromo-4-ethoxy-N-(3-hydroxypropylcarbamothioyl)benzamide CAS Name: 3-bromo-4-ethoxy-N-[(3-hydroxypropylamino)-sulfanylidenemethyl]benzamide IUPAC Name: 3-bromo-4-ethoxy-N-(3-hydroxypropylcarbamothioyl)benzamide Traditional Name: 3-bromo-4-ethoxy-N-(3-hydroxypropylthiocarbamoyl)benzamide Formula: C13H17BrN2O3S MolecularWeight: 361.25468

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Descriptors Computed from Structure

Canonical SMILES:

CCOC1=C(C=C(C=C1)C(=O)NC(=S)NCCCO)Br

Isomeric SMILES

CCOC1=C(C=C(C=C1)C(=O)NC(=S)NCCCO)Br

InChI

InChI=1S/C13H17BrN2O3S/c1-2-19-11-5-4-9(8-10(11)14)12(18)16-13(20)15-6-3-7-17/h4-5,8,17H,2-3,6-7H2,1H3,(H2,15,16,18,20)