3-bromanyl-N-(oxolan-2-ylmethylcarbamothioyl)-4-propoxy-benzamide

Systemtic Name: 3-bromanyl-N-(oxolan-2-ylmethylcarbamothioyl)-4-propoxy-benzamide Openeye Name: 3-bromo-4-propoxy-N-(tetrahydrofuran-2-ylmethylcarbamothioyl)benzamide CAS Name: 3-bromo-N-[(2-oxolanylmethylamino)-sulfanylidenemethyl]-4-propoxybenzamide IUPAC Name: 3-bromo-N-(oxolan-2-ylmethylcarbamothioyl)-4-propoxybenzamide Traditional Name: 3-bromo-4-propoxy-N-(tetrahydrofurfurylthiocarbamoyl)benzamide Formula: C16H21BrN2O3S MolecularWeight: 401.31854

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Descriptors Computed from Structure

Canonical SMILES:

CCCOC1=C(C=C(C=C1)C(=O)NC(=S)NCC2CCCO2)Br

Isomeric SMILES

CCCOC1=C(C=C(C=C1)C(=O)NC(=S)NCC2CCCO2)Br

InChI

InChI=1S/C16H21BrN2O3S/c1-2-7-22-14-6-5-11(9-13(14)17)15(20)19-16(23)18-10-12-4-3-8-21-12/h5-6,9,12H,2-4,7-8,10H2,1H3,(H2,18,19,20,23)