N-[(5-nitro-2-oxidanyl-phenyl)methyl]-2-sulfanylidene-1H-pyridine-3-carboxamide

Systemtic Name: N-[(5-nitro-2-oxidanyl-phenyl)methyl]-2-sulfanylidene-1H-pyridine-3-carboxamide Openeye Name: N-[(2-hydroxy-5-nitro-phenyl)methyl]-2-thioxo-1H-pyridine-3-carboxamide CAS Name: N-[(2-hydroxy-5-nitrophenyl)methyl]-2-sulfanylidene-1H-pyridine-3-carboxamide IUPAC Name: N-[(2-hydroxy-5-nitrophenyl)methyl]-2-sulfanylidene-1H-pyridine-3-carboxamide Traditional Name: N-(2-hydroxy-5-nitro-benzyl)-2-thioxo-1H-pyridine-3-carboxamide Formula: C13H11N3O4S MolecularWeight: 305.30914

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Descriptors Computed from Structure

Canonical SMILES:

C1=CNC(=S)C(=C1)C(=O)NCC2=C(C=CC(=C2)[N+](=O)[O-])O

Isomeric SMILES

C1=CNC(=S)C(=C1)C(=O)NCC2=C(C=CC(=C2)[N+](=O)[O-])O

InChI

InChI=1S/C13H11N3O4S/c17-11-4-3-9(16(19)20)6-8(11)7-15-12(18)10-2-1-5-14-13(10)21/h1-6,17H,7H2,(H,14,21)(H,15,18)