2-[2-oxidanylidene-2-(5-pyrrolidin-1-ylcarbonyl-1H-pyrrol-3-yl)ethyl]sulfanylpyridine-3-carbonitrile

Systemtic Name: 2-[2-oxidanylidene-2-(5-pyrrolidin-1-ylcarbonyl-1H-pyrrol-3-yl)ethyl]sulfanylpyridine-3-carbonitrile Openeye Name: 2-[2-oxo-2-[5-(pyrrolidine-1-carbonyl)-1H-pyrrol-3-yl]ethyl]sulfanylpyridine-3-carbonitrile CAS Name: 2-[[2-oxo-2-[5-[oxo(1-pyrrolidinyl)methyl]-1H-pyrrol-3-yl]ethyl]thio]-3-pyridinecarbonitrile IUPAC Name: 2-[2-oxo-2-[5-(pyrrolidine-1-carbonyl)-1H-pyrrol-3-yl]ethyl]sulfanylpyridine-3-carbonitrile Traditional Name: 2-[[2-keto-2-[5-(pyrrolidine-1-carbonyl)-1H-pyrrol-3-yl]ethyl]thio]nicotinonitrile Formula: C17H16N4O2S MolecularWeight: 340.39954

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Descriptors Computed from Structure

Canonical SMILES:

C1CCN(C1)C(=O)C2=CC(=CN2)C(=O)CSC3=C(C=CC=N3)C#N

Isomeric SMILES

C1CCN(C1)C(=O)C2=CC(=CN2)C(=O)CSC3=C(C=CC=N3)C#N

InChI

InChI=1S/C17H16N4O2S/c18-9-12-4-3-5-19-16(12)24-11-15(22)13-8-14(20-10-13)17(23)21-6-1-2-7-21/h3-5,8,10,20H,1-2,6-7,11H2