3-[(2-oxidanylidenepyridin-1-yl)methyl]benzenecarbothioamide

Systemtic Name: 3-[(2-oxidanylidenepyridin-1-yl)methyl]benzenecarbothioamide Openeye Name: 3-[(2-oxo-1-pyridyl)methyl]benzenecarbothioamide CAS Name: 3-[(2-oxo-1-pyridinyl)methyl]benzenecarbothioamide IUPAC Name: 3-[(2-oxopyridin-1-yl)methyl]benzenecarbothioamide Traditional Name: 3-[(2-keto-1-pyridyl)methyl]thiobenzamide Formula: C13H12N2OS MolecularWeight: 244.31218

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC(=O)N(C=C1)CC2=CC=CC(=C2)C(=S)N

Isomeric SMILES

C1=CC(=O)N(C=C1)CC2=CC=CC(=C2)C(=S)N

InChI

InChI=1S/C13H12N2OS/c14-13(17)11-5-3-4-10(8-11)9-15-7-2-1-6-12(15)16/h1-8H,9H2,(H2,14,17)