N-(4-cyanophenyl)-2-(5-nitropyridin-2-yl)sulfanyl-ethanamide

Systemtic Name: N-(4-cyanophenyl)-2-(5-nitropyridin-2-yl)sulfanyl-ethanamide Openeye Name: N-(4-cyanophenyl)-2-[(5-nitro-2-pyridyl)sulfanyl]acetamide CAS Name: N-(4-cyanophenyl)-2-[(5-nitro-2-pyridinyl)thio]acetamide IUPAC Name: N-(4-cyanophenyl)-2-(5-nitropyridin-2-yl)sulfanylacetamide Traditional Name: N-(4-cyanophenyl)-2-[(5-nitro-2-pyridyl)thio]acetamide Formula: C14H10N4O3S MolecularWeight: 314.3192

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC(=CC=C1C#N)NC(=O)CSC2=NC=C(C=C2)[N+](=O)[O-]

Isomeric SMILES

C1=CC(=CC=C1C#N)NC(=O)CSC2=NC=C(C=C2)[N+](=O)[O-]

InChI

InChI=1S/C14H10N4O3S/c15-7-10-1-3-11(4-2-10)17-13(19)9-22-14-6-5-12(8-16-14)18(20)21/h1-6,8H,9H2,(H,17,19)