5-bromanyl-2-butoxy-N-(2-oxidanylpropylcarbamothioyl)benzamide

Systemtic Name: 5-bromanyl-2-butoxy-N-(2-oxidanylpropylcarbamothioyl)benzamide Openeye Name: 5-bromo-2-butoxy-N-(2-hydroxypropylcarbamothioyl)benzamide CAS Name: 5-bromo-2-butoxy-N-[(2-hydroxypropylamino)-sulfanylidenemethyl]benzamide IUPAC Name: 5-bromo-2-butoxy-N-(2-hydroxypropylcarbamothioyl)benzamide Traditional Name: 5-bromo-2-butoxy-N-(2-hydroxypropylthiocarbamoyl)benzamide Formula: C15H21BrN2O3S MolecularWeight: 389.30784

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Descriptors Computed from Structure

Canonical SMILES:

CCCCOC1=C(C=C(C=C1)Br)C(=O)NC(=S)NCC(C)O

Isomeric SMILES

CCCCOC1=C(C=C(C=C1)Br)C(=O)NC(=S)NCC(C)O

InChI

InChI=1S/C15H21BrN2O3S/c1-3-4-7-21-13-6-5-11(16)8-12(13)14(20)18-15(22)17-9-10(2)19/h5-6,8,10,19H,3-4,7,9H2,1-2H3,(H2,17,18,20,22)