N-(2-phenylsulfanylethylcarbamothioyl)pyridine-3-carboxamide

Systemtic Name: N-(2-phenylsulfanylethylcarbamothioyl)pyridine-3-carboxamide Openeye Name: N-(2-phenylsulfanylethylcarbamothioyl)pyridine-3-carboxamide CAS Name: N-[[2-(phenylthio)ethylamino]-sulfanylidenemethyl]-3-pyridinecarboxamide IUPAC Name: N-(2-phenylsulfanylethylcarbamothioyl)pyridine-3-carboxamide Traditional Name: N-[2-(phenylthio)ethylthiocarbamoyl]nicotinamide Formula: C15H15N3OS2 MolecularWeight: 317.4291

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC=C(C=C1)SCCNC(=S)NC(=O)C2=CN=CC=C2

Isomeric SMILES

C1=CC=C(C=C1)SCCNC(=S)NC(=O)C2=CN=CC=C2

InChI

InChI=1S/C15H15N3OS2/c19-14(12-5-4-8-16-11-12)18-15(20)17-9-10-21-13-6-2-1-3-7-13/h1-8,11H,9-10H2,(H2,17,18,19,20)