2-[(3-nitrophenyl)methylsulfanyl]-N-pyridin-4-yl-pyridine-3-carboxamide

Systemtic Name: 2-[(3-nitrophenyl)methylsulfanyl]-N-pyridin-4-yl-pyridine-3-carboxamide Openeye Name: 2-[(3-nitrophenyl)methylsulfanyl]-N-(4-pyridyl)pyridine-3-carboxamide CAS Name: 2-[(3-nitrophenyl)methylthio]-N-pyridin-4-yl-3-pyridinecarboxamide IUPAC Name: 2-[(3-nitrophenyl)methylsulfanyl]-N-pyridin-4-ylpyridine-3-carboxamide Traditional Name: 2-[(3-nitrobenzyl)thio]-N-(4-pyridyl)nicotinamide Formula: C18H14N4O3S MolecularWeight: 366.39376

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC(=CC(=C1)[N+](=O)[O-])CSC2=C(C=CC=N2)C(=O)NC3=CC=NC=C3

Isomeric SMILES

C1=CC(=CC(=C1)[N+](=O)[O-])CSC2=C(C=CC=N2)C(=O)NC3=CC=NC=C3

InChI

InChI=1S/C18H14N4O3S/c23-17(21-14-6-9-19-10-7-14)16-5-2-8-20-18(16)26-12-13-3-1-4-15(11-13)22(24)25/h1-11H,12H2,(H,19,21,23)