4-nitro-N-(3-nitro-5-pyridin-2-ylsulfanyl-phenyl)benzamide

Systemtic Name: 4-nitro-N-(3-nitro-5-pyridin-2-ylsulfanyl-phenyl)benzamide Openeye Name: 4-nitro-N-[3-nitro-5-(2-pyridylsulfanyl)phenyl]benzamide CAS Name: 4-nitro-N-[3-nitro-5-(2-pyridinylthio)phenyl]benzamide IUPAC Name: 4-nitro-N-(3-nitro-5-pyridin-2-ylsulfanylphenyl)benzamide Traditional Name: 4-nitro-N-[3-nitro-5-(2-pyridylthio)phenyl]benzamide Formula: C18H12N4O5S MolecularWeight: 396.37668

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC=NC(=C1)SC2=CC(=CC(=C2)[N+](=O)[O-])NC(=O)C3=CC=C(C=C3)[N+](=O)[O-]

Isomeric SMILES

C1=CC=NC(=C1)SC2=CC(=CC(=C2)[N+](=O)[O-])NC(=O)C3=CC=C(C=C3)[N+](=O)[O-]

InChI

InChI=1S/C18H12N4O5S/c23-18(12-4-6-14(7-5-12)21(24)25)20-13-9-15(22(26)27)11-16(10-13)28-17-3-1-2-8-19-17/h1-11H,(H,20,23)