4-nitro-N-(2-pyridin-2-ylsulfanylethyl)benzamide

Systemtic Name: 4-nitro-N-(2-pyridin-2-ylsulfanylethyl)benzamide Openeye Name: 4-nitro-N-[2-(2-pyridylsulfanyl)ethyl]benzamide CAS Name: 4-nitro-N-[2-(2-pyridinylthio)ethyl]benzamide IUPAC Name: 4-nitro-N-(2-pyridin-2-ylsulfanylethyl)benzamide Traditional Name: 4-nitro-N-[2-(2-pyridylthio)ethyl]benzamide Formula: C14H13N3O3S MolecularWeight: 303.33632

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C14H13N3O3S/c18-14(11-4-6-12(7-5-11)17(19)20)16-9-10-21-13-3-1-2-8-15-13/h1-8H,9-10H2,(H,16,18)