N-(2,6-dimethylphenyl)-2-(5-nitropyridin-2-yl)sulfanyl-ethanamide

Systemtic Name: N-(2,6-dimethylphenyl)-2-(5-nitropyridin-2-yl)sulfanyl-ethanamide Openeye Name: N-(2,6-dimethylphenyl)-2-[(5-nitro-2-pyridyl)sulfanyl]acetamide CAS Name: N-(2,6-dimethylphenyl)-2-[(5-nitro-2-pyridinyl)thio]acetamide IUPAC Name: N-(2,6-dimethylphenyl)-2-(5-nitropyridin-2-yl)sulfanylacetamide Traditional Name: N-(2,6-dimethylphenyl)-2-[(5-nitro-2-pyridyl)thio]acetamide Formula: C15H15N3O3S MolecularWeight: 317.3629

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CC1=C(C(=CC=C1)C)NC(=O)CSC2=NC=C(C=C2)[N+](=O)[O-]

Isomeric SMILES

CC1=C(C(=CC=C1)C)NC(=O)CSC2=NC=C(C=C2)[N+](=O)[O-]

InChI

InChI=1S/C15H15N3O3S/c1-10-4-3-5-11(2)15(10)17-13(19)9-22-14-7-6-12(8-16-14)18(20)21/h3-8H,9H2,1-2H3,(H,17,19)