N-(3-nitro-5-pyridin-2-ylsulfanyl-phenyl)propanamide

Systemtic Name: N-(3-nitro-5-pyridin-2-ylsulfanyl-phenyl)propanamide Openeye Name: N-[3-nitro-5-(2-pyridylsulfanyl)phenyl]propanamide CAS Name: N-[3-nitro-5-(2-pyridinylthio)phenyl]propanamide IUPAC Name: N-(3-nitro-5-pyridin-2-ylsulfanylphenyl)propanamide Traditional Name: N-[3-nitro-5-(2-pyridylthio)phenyl]propionamide Formula: C14H13N3O3S MolecularWeight: 303.33632

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Descriptors Computed from Structure

Canonical SMILES:

CCC(=O)NC1=CC(=CC(=C1)SC2=CC=CC=N2)[N+](=O)[O-]

Isomeric SMILES

CCC(=O)NC1=CC(=CC(=C1)SC2=CC=CC=N2)[N+](=O)[O-]

InChI

InChI=1S/C14H13N3O3S/c1-2-13(18)16-10-7-11(17(19)20)9-12(8-10)21-14-5-3-4-6-15-14/h3-9H,2H2,1H3,(H,16,18)