4-butoxy-N-(pyridin-3-ylcarbamothioyl)benzamide

Systemtic Name: 4-butoxy-N-(pyridin-3-ylcarbamothioyl)benzamide Openeye Name: 4-butoxy-N-(3-pyridylcarbamothioyl)benzamide CAS Name: 4-butoxy-N-[(3-pyridinylamino)-sulfanylidenemethyl]benzamide IUPAC Name: 4-butoxy-N-(pyridin-3-ylcarbamothioyl)benzamide Traditional Name: 4-butoxy-N-(3-pyridylthiocarbamoyl)benzamide Formula: C17H19N3O2S MolecularWeight: 329.41666

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Descriptors Computed from Structure

Canonical SMILES:

CCCCOC1=CC=C(C=C1)C(=O)NC(=S)NC2=CN=CC=C2

Isomeric SMILES

CCCCOC1=CC=C(C=C1)C(=O)NC(=S)NC2=CN=CC=C2

InChI

InChI=1S/C17H19N3O2S/c1-2-3-11-22-15-8-6-13(7-9-15)16(21)20-17(23)19-14-5-4-10-18-12-14/h4-10,12H,2-3,11H2,1H3,(H2,19,20,21,23)