4-phenyl-N-(pyridin-3-ylmethylcarbamothioyl)benzamide

Systemtic Name: 4-phenyl-N-(pyridin-3-ylmethylcarbamothioyl)benzamide Openeye Name: 4-phenyl-N-(3-pyridylmethylcarbamothioyl)benzamide CAS Name: 4-phenyl-N-[(3-pyridinylmethylamino)-sulfanylidenemethyl]benzamide IUPAC Name: 4-phenyl-N-(pyridin-3-ylmethylcarbamothioyl)benzamide Traditional Name: 4-phenyl-N-(3-pyridylmethylthiocarbamoyl)benzamide Formula: C20H17N3OS MolecularWeight: 347.43348

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC=C(C=C1)C2=CC=C(C=C2)C(=O)NC(=S)NCC3=CN=CC=C3

Isomeric SMILES

C1=CC=C(C=C1)C2=CC=C(C=C2)C(=O)NC(=S)NCC3=CN=CC=C3

InChI

InChI=1S/C20H17N3OS/c24-19(23-20(25)22-14-15-5-4-12-21-13-15)18-10-8-17(9-11-18)16-6-2-1-3-7-16/h1-13H,14H2,(H2,22,23,24,25)