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

Systemtic Name: 4-propoxy-N-(pyridin-3-ylcarbamothioyl)benzamide Openeye Name: 4-propoxy-N-(3-pyridylcarbamothioyl)benzamide CAS Name: 4-propoxy-N-[(3-pyridinylamino)-sulfanylidenemethyl]benzamide IUPAC Name: 4-propoxy-N-(pyridin-3-ylcarbamothioyl)benzamide Traditional Name: 4-propoxy-N-(3-pyridylthiocarbamoyl)benzamide Formula: C16H17N3O2S MolecularWeight: 315.39008

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Descriptors Computed from Structure

Canonical SMILES:

CCCOC1=CC=C(C=C1)C(=O)NC(=S)NC2=CN=CC=C2

Isomeric SMILES

CCCOC1=CC=C(C=C1)C(=O)NC(=S)NC2=CN=CC=C2

InChI

InChI=1S/C16H17N3O2S/c1-2-10-21-14-7-5-12(6-8-14)15(20)19-16(22)18-13-4-3-9-17-11-13/h3-9,11H,2,10H2,1H3,(H2,18,19,20,22)