N-(5-nitropyridin-2-yl)-2-(phenylmethylsulfanyl)ethanamide

Systemtic Name: N-(5-nitropyridin-2-yl)-2-(phenylmethylsulfanyl)ethanamide Openeye Name: 2-benzylsulfanyl-N-(5-nitro-2-pyridyl)acetamide CAS Name: N-(5-nitro-2-pyridinyl)-2-(phenylmethylthio)acetamide IUPAC Name: 2-benzylsulfanyl-N-(5-nitropyridin-2-yl)acetamide Traditional Name: 2-(benzylthio)-N-(5-nitro-2-pyridyl)acetamide Formula: C14H13N3O3S MolecularWeight: 303.33632

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

C1=CC=C(C=C1)CSCC(=O)NC2=NC=C(C=C2)[N+](=O)[O-]

Isomeric SMILES

C1=CC=C(C=C1)CSCC(=O)NC2=NC=C(C=C2)[N+](=O)[O-]

InChI

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