3-bromanyl-4-butoxy-N-(cyclopentylcarbamothioyl)benzamide

Systemtic Name: 3-bromanyl-4-butoxy-N-(cyclopentylcarbamothioyl)benzamide Openeye Name: 3-bromo-4-butoxy-N-(cyclopentylcarbamothioyl)benzamide CAS Name: 3-bromo-4-butoxy-N-[(cyclopentylamino)-sulfanylidenemethyl]benzamide IUPAC Name: 3-bromo-4-butoxy-N-(cyclopentylcarbamothioyl)benzamide Traditional Name: 3-bromo-4-butoxy-N-(cyclopentylthiocarbamoyl)benzamide Formula: C17H23BrN2O2S MolecularWeight: 399.34572

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Descriptors Computed from Structure

Canonical SMILES:

CCCCOC1=C(C=C(C=C1)C(=O)NC(=S)NC2CCCC2)Br

Isomeric SMILES

CCCCOC1=C(C=C(C=C1)C(=O)NC(=S)NC2CCCC2)Br

InChI

InChI=1S/C17H23BrN2O2S/c1-2-3-10-22-15-9-8-12(11-14(15)18)16(21)20-17(23)19-13-6-4-5-7-13/h8-9,11,13H,2-7,10H2,1H3,(H2,19,20,21,23)