N-[(2-ethanoylpyridin-3-yl)methylideneamino]pyrrolidine-1-carbothioamide

Systemtic Name: N-[(2-ethanoylpyridin-3-yl)methylideneamino]pyrrolidine-1-carbothioamide Openeye Name: N-[(2-acetyl-3-pyridyl)methyleneamino]pyrrolidine-1-carbothioamide CAS Name: N-[(2-acetyl-3-pyridinyl)methylideneamino]-1-pyrrolidinecarbothioamide IUPAC Name: N-[(2-acetylpyridin-3-yl)methylideneamino]pyrrolidine-1-carbothioamide Traditional Name: N-[(2-acetyl-3-pyridyl)methyleneamino]pyrrolidine-1-carbothioamide Formula: C13H16N4OS MolecularWeight: 276.35734

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Descriptors Computed from Structure

Canonical SMILES:

CC(=O)C1=C(C=CC=N1)C=NNC(=S)N2CCCC2

Isomeric SMILES

CC(=O)C1=C(C=CC=N1)C=NNC(=S)N2CCCC2

InChI

InChI=1S/C13H16N4OS/c1-10(18)12-11(5-4-6-14-12)9-15-16-13(19)17-7-2-3-8-17/h4-6,9H,2-3,7-8H2,1H3,(H,16,19)