2-(3-cyano-4,5,6-trimethyl-pyridin-2-yl)sulfanyl-N-(2-nitrophenyl)ethanamide

Systemtic Name: 2-(3-cyano-4,5,6-trimethyl-pyridin-2-yl)sulfanyl-N-(2-nitrophenyl)ethanamide Openeye Name: 2-[(3-cyano-4,5,6-trimethyl-2-pyridyl)sulfanyl]-N-(2-nitrophenyl)acetamide CAS Name: 2-[(3-cyano-4,5,6-trimethyl-2-pyridinyl)thio]-N-(2-nitrophenyl)acetamide IUPAC Name: 2-(3-cyano-4,5,6-trimethylpyridin-2-yl)sulfanyl-N-(2-nitrophenyl)acetamide Traditional Name: 2-[(3-cyano-4,5,6-trimethyl-2-pyridyl)thio]-N-(2-nitrophenyl)acetamide Formula: C17H16N4O3S MolecularWeight: 356.39894

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C(N=C(C(=C1C)C#N)SCC(=O)NC2=CC=CC=C2[N+](=O)[O-])C

Isomeric SMILES

CC1=C(N=C(C(=C1C)C#N)SCC(=O)NC2=CC=CC=C2[N+](=O)[O-])C

InChI

InChI=1S/C17H16N4O3S/c1-10-11(2)13(8-18)17(19-12(10)3)25-9-16(22)20-14-6-4-5-7-15(14)21(23)24/h4-7H,9H2,1-3H3,(H,20,22)